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

Systemtic Name: 2-[3-[(2-methylphenyl)methylsulfanyl]indol-1-yl]-1-piperidin-1-yl-ethanone Openeye Name: 2-[3-(o-tolylmethylsulfanyl)indol-1-yl]-1-(1-piperidyl)ethanone CAS Name: 2-[3-[(2-methylphenyl)methylthio]-1-indolyl]-1-(1-piperidinyl)ethanone IUPAC Name: 2-[3-[(2-methylphenyl)methylsulfanyl]indol-1-yl]-1-piperidin-1-ylethanone Traditional Name: 2-[3-[(2-methylbenzyl)thio]indol-1-yl]-1-piperidino-ethanone Formula: C23H26N2OS MolecularWeight: 378.53034

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1CSC2=CN(C3=CC=CC=C32)CC(=O)N4CCCCC4

Isomeric SMILES

CC1=CC=CC=C1CSC2=CN(C3=CC=CC=C32)CC(=O)N4CCCCC4

InChI

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