N-[(7S,10S)-10-ethylsulfanyl-1,2,3-trimethoxy-10-methylsulfanyl-9-oxidanyl-6,7-dihydro-5H-benzo[a]heptalen-7-yl]ethanamide

Systemtic Name: N-[(7S,10S)-10-ethylsulfanyl-1,2,3-trimethoxy-10-methylsulfanyl-9-oxidanyl-6,7-dihydro-5H-benzo[a]heptalen-7-yl]ethanamide Openeye Name: N-[(7S,10S)-10-ethylsulfanyl-9-hydroxy-1,2,3-trimethoxy-10-methylsulfanyl-6,7-dihydro-5H-benzo[a]heptalen-7-yl]acetamide CAS Name: N-[(7S,10S)-10-(ethylthio)-9-hydroxy-1,2,3-trimethoxy-10-(methylthio)-6,7-dihydro-5H-benzo[a]heptalen-7-yl]acetamide IUPAC Name: N-[(7S,10S)-10-ethylsulfanyl-9-hydroxy-1,2,3-trimethoxy-10-methylsulfanyl-6,7-dihydro-5H-benzo[a]heptalen-7-yl]acetamide Traditional Name: N-[(7S,10S)-10-(ethylthio)-9-hydroxy-1,2,3-trimethoxy-10-(methylthio)-6,7-dihydro-5H-benzo[a]heptalen-7-yl]acetamide Formula: C24H31NO5S2 MolecularWeight: 477.63664

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCSC1(C=CC2=C(C=C1O)C(CCC3=CC(=C(C(=C32)OC)OC)OC)NC(=O)C)SC

Isomeric SMILES

CCS[C@]1(C=CC2=C(C=C1O)[C@H](CCC3=CC(=C(C(=C32)OC)OC)OC)NC(=O)C)SC

InChI

InChI=1S/C24H31NO5S2/c1-7-32-24(31-6)11-10-16-17(13-20(24)27)18(25-14(2)26)9-8-15-12-19(28-3)22(29-4)23(30-5)21(15)16/h10-13,18,27H,7-9H2,1-6H3,(H,25,26)/t18-,24-/m0/s1