N-[2-(1-methyl-2,3-dihydroindol-5-yl)-2-(4-methylpiperazin-1-yl)ethyl]-2-(phenylmethylsulfanyl)ethanamide

Systemtic Name: N-[2-(1-methyl-2,3-dihydroindol-5-yl)-2-(4-methylpiperazin-1-yl)ethyl]-2-(phenylmethylsulfanyl)ethanamide Openeye Name: 2-benzylsulfanyl-N-[2-(1-methylindolin-5-yl)-2-(4-methylpiperazin-1-yl)ethyl]acetamide CAS Name: N-[2-(1-methyl-2,3-dihydroindol-5-yl)-2-(4-methyl-1-piperazinyl)ethyl]-2-(phenylmethylthio)acetamide IUPAC Name: 2-benzylsulfanyl-N-[2-(1-methyl-2,3-dihydroindol-5-yl)-2-(4-methylpiperazin-1-yl)ethyl]acetamide Traditional Name: 2-(benzylthio)-N-[2-(1-methylindolin-5-yl)-2-(4-methylpiperazino)ethyl]acetamide Formula: C25H34N4OS MolecularWeight: 438.62866

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCN(CC1)C(CNC(=O)CSCC2=CC=CC=C2)C3=CC4=C(C=C3)N(CC4)C

Isomeric SMILES

CN1CCN(CC1)C(CNC(=O)CSCC2=CC=CC=C2)C3=CC4=C(C=C3)N(CC4)C

InChI

InChI=1S/C25H34N4OS/c1-27-12-14-29(15-13-27)24(21-8-9-23-22(16-21)10-11-28(23)2)17-26-25(30)19-31-18-20-6-4-3-5-7-20/h3-9,16,24H,10-15,17-19H2,1-2H3,(H,26,30)