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Chemistry, part 2

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Concept information

organooxygen compound > ether > aromatic ether > n-[[(4r,5r)-8-(1-cyclohexenyl)-2-[(2r)-1-hydroxypropan-2-yl]-4-methyl-1,1-dioxo-4,5-dihydro-3h-6,1$l^/{6/},2-benzoxathiazocin-5-yl]methyl]-n-methyl-2-(3-pyridinyl)acetamide
... > chemical entity > molecular entity > polyatomic entity > molecule > cyclic compound > organic cyclic compound > organic aromatic compound > aromatic ether > n-[[(4r,5r)-8-(1-cyclohexenyl)-2-[(2r)-1-hydroxypropan-2-yl]-4-methyl-1,1-dioxo-4,5-dihydro-3h-6,1$l^/{6/},2-benzoxathiazocin-5-yl]methyl]-n-methyl-2-(3-pyridinyl)acetamide
... > 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 > aromatic ether > n-[[(4r,5r)-8-(1-cyclohexenyl)-2-[(2r)-1-hydroxypropan-2-yl]-4-methyl-1,1-dioxo-4,5-dihydro-3h-6,1$l^/{6/},2-benzoxathiazocin-5-yl]methyl]-n-methyl-2-(3-pyridinyl)acetamide
... > chemical entity > molecular entity > polyatomic entity > molecule > organic molecule > organic cyclic compound > organic aromatic compound > aromatic ether > n-[[(4r,5r)-8-(1-cyclohexenyl)-2-[(2r)-1-hydroxypropan-2-yl]-4-methyl-1,1-dioxo-4,5-dihydro-3h-6,1$l^/{6/},2-benzoxathiazocin-5-yl]methyl]-n-methyl-2-(3-pyridinyl)acetamide

Preferred term

n-[[(4r,5r)-8-(1-cyclohexenyl)-2-[(2r)-1-hydroxypropan-2-yl]-4-methyl-1,1-dioxo-4,5-dihydro-3h-6,1$l^/{6/},2-benzoxathiazocin-5-yl]methyl]-n-methyl-2-(3-pyridinyl)acetamide  

Type

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

Broader concept

charge

  • 0

formula

  • C28H37N3O5S

inchi

  • InChI=1S/C28H37N3O5S/c1-20-17-31(21(2)19-32)37(34,35)27-12-11-24(23-9-5-4-6-10-23)15-25(27)36-26(20)18-30(3)28(33)14-22-8-7-13-29-16-22/h7-9,11-13,15-16,20-21,26,32H,4-6,10,14,17-19H2,1-3H3/t20-,21-,26+/m1/s1

inchikey

  • INVIOEDNEQSFGP-YPCDYVTLSA-N

mass

  • 527.678

monoisotopicmass

  • 527.24539

smiles

  • C[C@@H]1CN(S(=O)(=O)C2=C(C=C(C=C2)C3=CCCCC3)O[C@H]1CN(C)C(=O)CC4=CN=CC=C4)[C@H](C)CO

subset

  • 2_STAR

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:126578

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