3-[[4-(3-chloranyl-4-methyl-phenyl)-1,2,4-triazol-3-yl]sulfanyl]propanamide

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

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)N2C=NN=C2SCCC(=O)N)Cl

Isomeric SMILES

CC1=C(C=C(C=C1)N2C=NN=C2SCCC(=O)N)Cl

InChI

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