3-(4-chlorophenyl)-N-(3-methyl-5-methylsulfanyl-1,2,4-triazol-4-yl)prop-2-enamide

Systemtic Name: 3-(4-chlorophenyl)-N-(3-methyl-5-methylsulfanyl-1,2,4-triazol-4-yl)prop-2-enamide Openeye Name: 3-(4-chlorophenyl)-N-(3-methyl-5-methylsulfanyl-1,2,4-triazol-4-yl)prop-2-enamide CAS Name: 3-(4-chlorophenyl)-N-[3-methyl-5-(methylthio)-1,2,4-triazol-4-yl]-2-propenamide IUPAC Name: 3-(4-chlorophenyl)-N-(3-methyl-5-methylsulfanyl-1,2,4-triazol-4-yl)prop-2-enamide Traditional Name: 3-(4-chlorophenyl)-N-[3-methyl-5-(methylthio)-1,2,4-triazol-4-yl]acrylamide Formula: C13H13ClN4OS MolecularWeight: 308.78652

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN=C(N1NC(=O)C=CC2=CC=C(C=C2)Cl)SC

Isomeric SMILES

CC1=NN=C(N1NC(=O)C=CC2=CC=C(C=C2)Cl)SC

InChI

InChI=1S/C13H13ClN4OS/c1-9-15-16-13(20-2)18(9)17-12(19)8-5-10-3-6-11(14)7-4-10/h3-8H,1-2H3,(H,17,19)