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

Systemtic Name: 1-(3-chlorophenyl)-2-[(4-cyclopropyl-5-piperidin-1-yl-1,2,4-triazol-3-yl)sulfanyl]ethanone Openeye Name: 1-(3-chlorophenyl)-2-[[4-cyclopropyl-5-(1-piperidyl)-1,2,4-triazol-3-yl]sulfanyl]ethanone CAS Name: 1-(3-chlorophenyl)-2-[[4-cyclopropyl-5-(1-piperidinyl)-1,2,4-triazol-3-yl]thio]ethanone IUPAC Name: 1-(3-chlorophenyl)-2-[(4-cyclopropyl-5-piperidin-1-yl-1,2,4-triazol-3-yl)sulfanyl]ethanone Traditional Name: 1-(3-chlorophenyl)-2-[(4-cyclopropyl-5-piperidino-1,2,4-triazol-3-yl)thio]ethanone Formula: C18H21ClN4OS MolecularWeight: 376.90354

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)C2=NN=C(N2C3CC3)SCC(=O)C4=CC(=CC=C4)Cl

Isomeric SMILES

C1CCN(CC1)C2=NN=C(N2C3CC3)SCC(=O)C4=CC(=CC=C4)Cl

InChI

InChI=1S/C18H21ClN4OS/c19-14-6-4-5-13(11-14)16(24)12-25-18-21-20-17(23(18)15-7-8-15)22-9-2-1-3-10-22/h4-6,11,15H,1-3,7-10,12H2