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

Systemtic Name: 1-(4-chlorophenyl)-2-[(5-propyl-1H-1,2,4-triazol-3-yl)sulfanyl]ethanone Openeye Name: 1-(4-chlorophenyl)-2-[(5-propyl-1H-1,2,4-triazol-3-yl)sulfanyl]ethanone CAS Name: 1-(4-chlorophenyl)-2-[(5-propyl-1H-1,2,4-triazol-3-yl)thio]ethanone IUPAC Name: 1-(4-chlorophenyl)-2-[(5-propyl-1H-1,2,4-triazol-3-yl)sulfanyl]ethanone Traditional Name: 1-(4-chlorophenyl)-2-[(5-propyl-1H-1,2,4-triazol-3-yl)thio]ethanone Formula: C13H14ClN3OS MolecularWeight: 295.78776

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=NC(=NN1)SCC(=O)C2=CC=C(C=C2)Cl

Isomeric SMILES

CCCC1=NC(=NN1)SCC(=O)C2=CC=C(C=C2)Cl

InChI

InChI=1S/C13H14ClN3OS/c1-2-3-12-15-13(17-16-12)19-8-11(18)9-4-6-10(14)7-5-9/h4-7H,2-3,8H2,1H3,(H,15,16,17)