N-[2-(1H-indol-3-ylsulfanyl)ethyl]-2-(4-methylphenyl)carbonyl-benzamide

Systemtic Name: N-[2-(1H-indol-3-ylsulfanyl)ethyl]-2-(4-methylphenyl)carbonyl-benzamide Openeye Name: N-[2-(1H-indol-3-ylsulfanyl)ethyl]-2-(4-methylbenzoyl)benzamide CAS Name: N-[2-(1H-indol-3-ylthio)ethyl]-2-[(4-methylphenyl)-oxomethyl]benzamide IUPAC Name: N-[2-(1H-indol-3-ylsulfanyl)ethyl]-2-(4-methylbenzoyl)benzamide Traditional Name: N-[2-(1H-indol-3-ylthio)ethyl]-2-p-toluoyl-benzamide Formula: C25H22N2O2S MolecularWeight: 414.51938

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(=O)C2=CC=CC=C2C(=O)NCCSC3=CNC4=CC=CC=C43

Isomeric SMILES

CC1=CC=C(C=C1)C(=O)C2=CC=CC=C2C(=O)NCCSC3=CNC4=CC=CC=C43

InChI

InChI=1S/C25H22N2O2S/c1-17-10-12-18(13-11-17)24(28)19-6-2-3-7-20(19)25(29)26-14-15-30-23-16-27-22-9-5-4-8-21(22)23/h2-13,16,27H,14-15H2,1H3,(H,26,29)