2-[1-[(4-methylphenyl)methyl]indol-3-yl]sulfanyl-1-piperidin-1-yl-ethanone

Systemtic Name: 2-[1-[(4-methylphenyl)methyl]indol-3-yl]sulfanyl-1-piperidin-1-yl-ethanone Openeye Name: 1-(1-piperidyl)-2-[1-(p-tolylmethyl)indol-3-yl]sulfanyl-ethanone CAS Name: 2-[[1-[(4-methylphenyl)methyl]-3-indolyl]thio]-1-(1-piperidinyl)ethanone IUPAC Name: 2-[1-[(4-methylphenyl)methyl]indol-3-yl]sulfanyl-1-piperidin-1-ylethanone Traditional Name: 2-[[1-(4-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=C(C=C1)CN2C=C(C3=CC=CC=C32)SCC(=O)N4CCCCC4

Isomeric SMILES

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

InChI

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