N-[2-(1-methyl-2,3-dihydroindol-5-yl)-2-piperidin-1-yl-ethyl]-2-(phenylmethylsulfanyl)ethanamide

Systemtic Name: N-[2-(1-methyl-2,3-dihydroindol-5-yl)-2-piperidin-1-yl-ethyl]-2-(phenylmethylsulfanyl)ethanamide Openeye Name: 2-benzylsulfanyl-N-[2-(1-methylindolin-5-yl)-2-(1-piperidyl)ethyl]acetamide CAS Name: N-[2-(1-methyl-2,3-dihydroindol-5-yl)-2-(1-piperidinyl)ethyl]-2-(phenylmethylthio)acetamide IUPAC Name: 2-benzylsulfanyl-N-[2-(1-methyl-2,3-dihydroindol-5-yl)-2-piperidin-1-ylethyl]acetamide Traditional Name: 2-(benzylthio)-N-[2-(1-methylindolin-5-yl)-2-piperidino-ethyl]acetamide Formula: C25H33N3OS MolecularWeight: 423.61402

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCC2=C1C=CC(=C2)C(CNC(=O)CSCC3=CC=CC=C3)N4CCCCC4

Isomeric SMILES

CN1CCC2=C1C=CC(=C2)C(CNC(=O)CSCC3=CC=CC=C3)N4CCCCC4

InChI

InChI=1S/C25H33N3OS/c1-27-15-12-22-16-21(10-11-23(22)27)24(28-13-6-3-7-14-28)17-26-25(29)19-30-18-20-8-4-2-5-9-20/h2,4-5,8-11,16,24H,3,6-7,12-15,17-19H2,1H3,(H,26,29)