2-[1-[(3-methylphenyl)methyl]indol-3-yl]sulfanyl-1-piperidin-1-yl-ethanone

Systemtic Name: 2-[1-[(3-methylphenyl)methyl]indol-3-yl]sulfanyl-1-piperidin-1-yl-ethanone Openeye Name: 2-[1-(m-tolylmethyl)indol-3-yl]sulfanyl-1-(1-piperidyl)ethanone CAS Name: 2-[[1-[(3-methylphenyl)methyl]-3-indolyl]thio]-1-(1-piperidinyl)ethanone IUPAC Name: 2-[1-[(3-methylphenyl)methyl]indol-3-yl]sulfanyl-1-piperidin-1-ylethanone Traditional Name: 2-[[1-(3-methylbenzyl)indol-3-yl]thio]-1-piperidino-ethanone Formula: C23H26N2OS MolecularWeight: 378.53034

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)CN2C=C(C3=CC=CC=C32)SCC(=O)N4CCCCC4

Isomeric SMILES

CC1=CC(=CC=C1)CN2C=C(C3=CC=CC=C32)SCC(=O)N4CCCCC4

InChI

InChI=1S/C23H26N2OS/c1-18-8-7-9-19(14-18)15-25-16-22(20-10-3-4-11-21(20)25)27-17-23(26)24-12-5-2-6-13-24/h3-4,7-11,14,16H,2,5-6,12-13,15,17H2,1H3