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

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

CC(C(=O)N)SC1=NN=C(N1C)C2=CC=C(C=C2)Cl

Isomeric SMILES

CC(C(=O)N)SC1=NN=C(N1C)C2=CC=C(C=C2)Cl

InChI

InChI=1S/C12H13ClN4OS/c1-7(10(14)18)19-12-16-15-11(17(12)2)8-3-5-9(13)6-4-8/h3-7H,1-2H3,(H2,14,18)