3-(2,4-dichlorophenyl)-N-[(3-methyl-5-methylsulfanyl-1,2,4-triazol-4-yl)carbamothioyl]prop-2-enamide

Systemtic Name: 3-(2,4-dichlorophenyl)-N-[(3-methyl-5-methylsulfanyl-1,2,4-triazol-4-yl)carbamothioyl]prop-2-enamide Openeye Name: 3-(2,4-dichlorophenyl)-N-[(3-methyl-5-methylsulfanyl-1,2,4-triazol-4-yl)carbamothioyl]prop-2-enamide CAS Name: 3-(2,4-dichlorophenyl)-N-[[[3-methyl-5-(methylthio)-1,2,4-triazol-4-yl]amino]-sulfanylidenemethyl]-2-propenamide IUPAC Name: 3-(2,4-dichlorophenyl)-N-[(3-methyl-5-methylsulfanyl-1,2,4-triazol-4-yl)carbamothioyl]prop-2-enamide Traditional Name: 3-(2,4-dichlorophenyl)-N-[[3-methyl-5-(methylthio)-1,2,4-triazol-4-yl]thiocarbamoyl]acrylamide Formula: C14H13Cl2N5OS2 MolecularWeight: 402.32192

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H13Cl2N5OS2/c1-8-18-19-14(24-2)21(8)20-13(23)17-12(22)6-4-9-3-5-10(15)7-11(9)16/h3-7H,1-2H3,(H2,17,20,22,23)