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Concept information

... > chemical entity > molecular entity > main group molecular entity > p-block molecular entity > chalcogen molecular entity > sulfur molecular entity > organosulfur compound > organosulfur heterocyclic compound > benzothiophenes > 1-benzothiophenes > (2s,4s)-4-(1-benzothiophen-3-yl)-2-[[4-(hydroxymethyl)phenyl]methoxy]-n-(phenylmethyl)-3,4-dihydro-2h-pyran-6-carboxamide
... > chemical entity > molecular entity > polyatomic entity > molecule > cyclic compound > organic cyclic compound > organic heterocyclic compound > organosulfur heterocyclic compound > benzothiophenes > 1-benzothiophenes > (2s,4s)-4-(1-benzothiophen-3-yl)-2-[[4-(hydroxymethyl)phenyl]methoxy]-n-(phenylmethyl)-3,4-dihydro-2h-pyran-6-carboxamide
... > chemical entity > molecular entity > polyatomic entity > molecule > organic molecule > organic cyclic compound > organic heterocyclic compound > organosulfur heterocyclic compound > benzothiophenes > 1-benzothiophenes > (2s,4s)-4-(1-benzothiophen-3-yl)-2-[[4-(hydroxymethyl)phenyl]methoxy]-n-(phenylmethyl)-3,4-dihydro-2h-pyran-6-carboxamide
... > chemical entity > molecular entity > polyatomic entity > molecule > cyclic compound > organic cyclic compound > organic heterocyclic compound > organic heteropolycyclic compound > organic heterobicyclic compound > benzothiophenes > 1-benzothiophenes > (2s,4s)-4-(1-benzothiophen-3-yl)-2-[[4-(hydroxymethyl)phenyl]methoxy]-n-(phenylmethyl)-3,4-dihydro-2h-pyran-6-carboxamide
... > chemical entity > molecular entity > polyatomic entity > molecule > organic molecule > organic cyclic compound > organic heterocyclic compound > organic heteropolycyclic compound > organic heterobicyclic compound > benzothiophenes > 1-benzothiophenes > (2s,4s)-4-(1-benzothiophen-3-yl)-2-[[4-(hydroxymethyl)phenyl]methoxy]-n-(phenylmethyl)-3,4-dihydro-2h-pyran-6-carboxamide

Preferred term

(2s,4s)-4-(1-benzothiophen-3-yl)-2-[[4-(hydroxymethyl)phenyl]methoxy]-n-(phenylmethyl)-3,4-dihydro-2h-pyran-6-carboxamide  

Type

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

Broader concept

charge

  • 0

formula

  • C29H27NO4S

inchi

  • InChI=1S/C29H27NO4S/c31-17-21-10-12-22(13-11-21)18-33-28-15-23(25-19-35-27-9-5-4-8-24(25)27)14-26(34-28)29(32)30-16-20-6-2-1-3-7-20/h1-14,19,23,28,31H,15-18H2,(H,30,32)/t23-,28+/m1/s1

inchikey

  • HCHDWAVTMDCPLB-LXFBAYGMSA-N

mass

  • 485.596

monoisotopicmass

  • 485.16608

smiles

  • C1[C@@H](C=C(O[C@@H]1OCC2=CC=C(C=C2)CO)C(=O)NCC3=CC=CC=C3)C4=CSC5=CC=CC=C54

subset

  • 2_STAR

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:107615

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