3,4-dimethyl-N-[2-[3-(1-phenylethylsulfanyl)indol-1-yl]ethyl]benzamide

Systemtic Name: 3,4-dimethyl-N-[2-[3-(1-phenylethylsulfanyl)indol-1-yl]ethyl]benzamide Openeye Name: 3,4-dimethyl-N-[2-[3-(1-phenylethylsulfanyl)indol-1-yl]ethyl]benzamide CAS Name: 3,4-dimethyl-N-[2-[3-(1-phenylethylthio)-1-indolyl]ethyl]benzamide IUPAC Name: 3,4-dimethyl-N-[2-[3-(1-phenylethylsulfanyl)indol-1-yl]ethyl]benzamide Traditional Name: 3,4-dimethyl-N-[2-[3-(1-phenylethylthio)indol-1-yl]ethyl]benzamide Formula: C27H28N2OS MolecularWeight: 428.58902

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(=O)NCCN2C=C(C3=CC=CC=C32)SC(C)C4=CC=CC=C4)C

Isomeric SMILES

CC1=C(C=C(C=C1)C(=O)NCCN2C=C(C3=CC=CC=C32)SC(C)C4=CC=CC=C4)C

InChI

InChI=1S/C27H28N2OS/c1-19-13-14-23(17-20(19)2)27(30)28-15-16-29-18-26(24-11-7-8-12-25(24)29)31-21(3)22-9-5-4-6-10-22/h4-14,17-18,21H,15-16H2,1-3H3,(H,28,30)