2-(2,3-dihydro-1H-inden-5-ylsulfanyl)-N-[4-[4-(3-methylphenyl)piperazin-1-yl]butyl]ethanamide

Systemtic Name: 2-(2,3-dihydro-1H-inden-5-ylsulfanyl)-N-[4-[4-(3-methylphenyl)piperazin-1-yl]butyl]ethanamide Openeye Name: 2-indan-5-ylsulfanyl-N-[4-[4-(m-tolyl)piperazin-1-yl]butyl]acetamide CAS Name: 2-(2,3-dihydro-1H-inden-5-ylthio)-N-[4-[4-(3-methylphenyl)-1-piperazinyl]butyl]acetamide IUPAC Name: 2-(2,3-dihydro-1H-inden-5-ylsulfanyl)-N-[4-[4-(3-methylphenyl)piperazin-1-yl]butyl]acetamide Traditional Name: 2-(indan-5-ylthio)-N-[4-[4-(m-tolyl)piperazino]butyl]acetamide Formula: C26H35N3OS MolecularWeight: 437.6406

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)N2CCN(CC2)CCCCNC(=O)CSC3=CC4=C(CCC4)C=C3

Isomeric SMILES

CC1=CC(=CC=C1)N2CCN(CC2)CCCCNC(=O)CSC3=CC4=C(CCC4)C=C3

InChI

InChI=1S/C26H35N3OS/c1-21-6-4-9-24(18-21)29-16-14-28(15-17-29)13-3-2-12-27-26(30)20-31-25-11-10-22-7-5-8-23(22)19-25/h4,6,9-11,18-19H,2-3,5,7-8,12-17,20H2,1H3,(H,27,30)