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Concept information

... > chemical entity > molecular entity > polyatomic entity > molecule > cyclic compound > organic cyclic compound > organic aromatic compound > biaryl > biphenyls > 4-[4-[(8s,9r,10s)-6-ethylsulfonyl-10-(hydroxymethyl)-1,6-diazabicyclo[6.2.0]decan-9-yl]phenyl]-n,n-dimethylbenzamide
... > chemical entity > molecular entity > main group molecular entity > p-block molecular entity > carbon group molecular entity > organic molecular entity > organic molecule > organic cyclic compound > organic aromatic compound > biaryl > biphenyls > 4-[4-[(8s,9r,10s)-6-ethylsulfonyl-10-(hydroxymethyl)-1,6-diazabicyclo[6.2.0]decan-9-yl]phenyl]-n,n-dimethylbenzamide
... > chemical entity > molecular entity > polyatomic entity > molecule > organic molecule > organic cyclic compound > organic aromatic compound > biaryl > biphenyls > 4-[4-[(8s,9r,10s)-6-ethylsulfonyl-10-(hydroxymethyl)-1,6-diazabicyclo[6.2.0]decan-9-yl]phenyl]-n,n-dimethylbenzamide
... > chemical entity > molecular entity > polyatomic entity > molecule > cyclic compound > organic cyclic compound > organic aromatic compound > benzenoid aromatic compound > biphenyls > 4-[4-[(8s,9r,10s)-6-ethylsulfonyl-10-(hydroxymethyl)-1,6-diazabicyclo[6.2.0]decan-9-yl]phenyl]-n,n-dimethylbenzamide
... > chemical entity > molecular entity > polyatomic entity > molecule > organic molecule > organic cyclic compound > organic aromatic compound > benzenoid aromatic compound > biphenyls > 4-[4-[(8s,9r,10s)-6-ethylsulfonyl-10-(hydroxymethyl)-1,6-diazabicyclo[6.2.0]decan-9-yl]phenyl]-n,n-dimethylbenzamide
... > chemical entity > molecular entity > polyatomic entity > molecule > cyclic compound > organic cyclic compound > carbocyclic compound > benzenoid aromatic compound > biphenyls > 4-[4-[(8s,9r,10s)-6-ethylsulfonyl-10-(hydroxymethyl)-1,6-diazabicyclo[6.2.0]decan-9-yl]phenyl]-n,n-dimethylbenzamide
... > chemical entity > molecular entity > polyatomic entity > molecule > organic molecule > organic cyclic compound > carbocyclic compound > benzenoid aromatic compound > biphenyls > 4-[4-[(8s,9r,10s)-6-ethylsulfonyl-10-(hydroxymethyl)-1,6-diazabicyclo[6.2.0]decan-9-yl]phenyl]-n,n-dimethylbenzamide

Preferred term

4-[4-[(8s,9r,10s)-6-ethylsulfonyl-10-(hydroxymethyl)-1,6-diazabicyclo[6.2.0]decan-9-yl]phenyl]-n,n-dimethylbenzamide  

Type

  • http://www.irandoc.ac.ir/onto/irandoc-meta/Concept

Broader concept

charge

  • 0

formula

  • C26H35N3O4S

inchi

  • InChI=1S/C26H35N3O4S/c1-4-34(32,33)28-15-5-6-16-29-23(17-28)25(24(29)18-30)21-11-7-19(8-12-21)20-9-13-22(14-10-20)26(31)27(2)3/h7-14,23-25,30H,4-6,15-18H2,1-3H3/t23-,24-,25-/m1/s1

inchikey

  • XKMPVOSJABXCIB-UBFVSLLYSA-N

mass

  • 485.641

monoisotopicmass

  • 485.23483

smiles

  • CCS(=O)(=O)N1CCCCN2[C@H](C1)[C@H]([C@H]2CO)C3=CC=C(C=C3)C4=CC=C(C=C4)C(=O)N(C)C

subset

  • 2_STAR

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:129964

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