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

Systemtic Name: 1-(4-chlorophenyl)-2-[(5-cyclopentyl-1H-1,2,4-triazol-3-yl)sulfanyl]ethanone Openeye Name: 1-(4-chlorophenyl)-2-[(5-cyclopentyl-1H-1,2,4-triazol-3-yl)sulfanyl]ethanone CAS Name: 1-(4-chlorophenyl)-2-[(5-cyclopentyl-1H-1,2,4-triazol-3-yl)thio]ethanone IUPAC Name: 1-(4-chlorophenyl)-2-[(5-cyclopentyl-1H-1,2,4-triazol-3-yl)sulfanyl]ethanone Traditional Name: 1-(4-chlorophenyl)-2-[(5-cyclopentyl-1H-1,2,4-triazol-3-yl)thio]ethanone Formula: C15H16ClN3OS MolecularWeight: 321.82504

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(C1)C2=NC(=NN2)SCC(=O)C3=CC=C(C=C3)Cl

Isomeric SMILES

C1CCC(C1)C2=NC(=NN2)SCC(=O)C3=CC=C(C=C3)Cl

InChI

InChI=1S/C15H16ClN3OS/c16-12-7-5-10(6-8-12)13(20)9-21-15-17-14(18-19-15)11-3-1-2-4-11/h5-8,11H,1-4,9H2,(H,17,18,19)