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

Systemtic Name: 2-[3-(phenylmethylsulfanyl)indol-1-yl]-1-piperidin-1-yl-ethanone Openeye Name: 2-(3-benzylsulfanylindol-1-yl)-1-(1-piperidyl)ethanone CAS Name: 2-[3-(phenylmethylthio)-1-indolyl]-1-(1-piperidinyl)ethanone IUPAC Name: 2-(3-benzylsulfanylindol-1-yl)-1-piperidin-1-ylethanone Traditional Name: 2-[3-(benzylthio)indol-1-yl]-1-piperidino-ethanone Formula: C22H24N2OS MolecularWeight: 364.50376

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)C(=O)CN2C=C(C3=CC=CC=C32)SCC4=CC=CC=C4

Isomeric SMILES

C1CCN(CC1)C(=O)CN2C=C(C3=CC=CC=C32)SCC4=CC=CC=C4

InChI

InChI=1S/C22H24N2OS/c25-22(23-13-7-2-8-14-23)16-24-15-21(19-11-5-6-12-20(19)24)26-17-18-9-3-1-4-10-18/h1,3-6,9-12,15H,2,7-8,13-14,16-17H2