2-[(5-cyclopentyl-1H-1,2,4-triazol-3-yl)sulfanyl]-1-[4-(3-methylphenyl)piperazin-1-yl]ethanone

Systemtic Name: 2-[(5-cyclopentyl-1H-1,2,4-triazol-3-yl)sulfanyl]-1-[4-(3-methylphenyl)piperazin-1-yl]ethanone Openeye Name: 2-[(5-cyclopentyl-1H-1,2,4-triazol-3-yl)sulfanyl]-1-[4-(m-tolyl)piperazin-1-yl]ethanone CAS Name: 2-[(5-cyclopentyl-1H-1,2,4-triazol-3-yl)thio]-1-[4-(3-methylphenyl)-1-piperazinyl]ethanone IUPAC Name: 2-[(5-cyclopentyl-1H-1,2,4-triazol-3-yl)sulfanyl]-1-[4-(3-methylphenyl)piperazin-1-yl]ethanone Traditional Name: 2-[(5-cyclopentyl-1H-1,2,4-triazol-3-yl)thio]-1-[4-(m-tolyl)piperazino]ethanone Formula: C20H27N5OS MolecularWeight: 385.52628

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)N2CCN(CC2)C(=O)CSC3=NNC(=N3)C4CCCC4

Isomeric SMILES

CC1=CC(=CC=C1)N2CCN(CC2)C(=O)CSC3=NNC(=N3)C4CCCC4

InChI

InChI=1S/C20H27N5OS/c1-15-5-4-8-17(13-15)24-9-11-25(12-10-24)18(26)14-27-20-21-19(22-23-20)16-6-2-3-7-16/h4-5,8,13,16H,2-3,6-7,9-12,14H2,1H3,(H,21,22,23)