3-[[5-(4-chlorophenyl)-4-methyl-1,2,4-triazol-3-yl]sulfanyl]propanamide

Systemtic Name: 3-[[5-(4-chlorophenyl)-4-methyl-1,2,4-triazol-3-yl]sulfanyl]propanamide Openeye Name: 3-[[5-(4-chlorophenyl)-4-methyl-1,2,4-triazol-3-yl]sulfanyl]propanamide CAS Name: 3-[[5-(4-chlorophenyl)-4-methyl-1,2,4-triazol-3-yl]thio]propanamide IUPAC Name: 3-[[5-(4-chlorophenyl)-4-methyl-1,2,4-triazol-3-yl]sulfanyl]propanamide Traditional Name: 3-[[5-(4-chlorophenyl)-4-methyl-1,2,4-triazol-3-yl]thio]propionamide Formula: C12H13ClN4OS MolecularWeight: 296.77582

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=NN=C1SCCC(=O)N)C2=CC=C(C=C2)Cl

Isomeric SMILES

CN1C(=NN=C1SCCC(=O)N)C2=CC=C(C=C2)Cl

InChI

InChI=1S/C12H13ClN4OS/c1-17-11(8-2-4-9(13)5-3-8)15-16-12(17)19-7-6-10(14)18/h2-5H,6-7H2,1H3,(H2,14,18)