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

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

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(C1)C2=NC(=NN2)SCC(=O)N3CCN(CC3)CC4=CC=CC=C4

Isomeric SMILES

C1CCC(C1)C2=NC(=NN2)SCC(=O)N3CCN(CC3)CC4=CC=CC=C4

InChI

InChI=1S/C20H27N5OS/c26-18(15-27-20-21-19(22-23-20)17-8-4-5-9-17)25-12-10-24(11-13-25)14-16-6-2-1-3-7-16/h1-3,6-7,17H,4-5,8-15H2,(H,21,22,23)