6-methoxy-3-(4-methylphenyl)sulfanyl-N-(4-phenylbutan-2-yl)-1H-indole-2-carboxamide

Systemtic Name: 6-methoxy-3-(4-methylphenyl)sulfanyl-N-(4-phenylbutan-2-yl)-1H-indole-2-carboxamide Openeye Name: 6-methoxy-N-(1-methyl-3-phenyl-propyl)-3-(p-tolylsulfanyl)-1H-indole-2-carboxamide CAS Name: 6-methoxy-3-[(4-methylphenyl)thio]-N-(4-phenylbutan-2-yl)-1H-indole-2-carboxamide IUPAC Name: 6-methoxy-3-(4-methylphenyl)sulfanyl-N-(4-phenylbutan-2-yl)-1H-indole-2-carboxamide Traditional Name: 6-methoxy-N-(1-methyl-3-phenyl-propyl)-3-(p-tolylthio)-1H-indole-2-carboxamide Formula: C27H28N2O2S MolecularWeight: 444.58842

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)SC2=C(NC3=C2C=CC(=C3)OC)C(=O)NC(C)CCC4=CC=CC=C4

Isomeric SMILES

CC1=CC=C(C=C1)SC2=C(NC3=C2C=CC(=C3)OC)C(=O)NC(C)CCC4=CC=CC=C4

InChI

InChI=1S/C27H28N2O2S/c1-18-9-14-22(15-10-18)32-26-23-16-13-21(31-3)17-24(23)29-25(26)27(30)28-19(2)11-12-20-7-5-4-6-8-20/h4-10,13-17,19,29H,11-12H2,1-3H3,(H,28,30)