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

Systemtic Name: 3-(furan-2-yl)-N-[(3-methyl-5-methylsulfanyl-1,2,4-triazol-4-yl)carbamothioyl]prop-2-enamide Openeye Name: 3-(2-furyl)-N-[(3-methyl-5-methylsulfanyl-1,2,4-triazol-4-yl)carbamothioyl]prop-2-enamide CAS Name: 3-(2-furanyl)-N-[[[3-methyl-5-(methylthio)-1,2,4-triazol-4-yl]amino]-sulfanylidenemethyl]-2-propenamide IUPAC Name: 3-(furan-2-yl)-N-[(3-methyl-5-methylsulfanyl-1,2,4-triazol-4-yl)carbamothioyl]prop-2-enamide Traditional Name: 3-(2-furyl)-N-[[3-methyl-5-(methylthio)-1,2,4-triazol-4-yl]thiocarbamoyl]acrylamide Formula: C12H13N5O2S2 MolecularWeight: 323.39392

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN=C(N1NC(=S)NC(=O)C=CC2=CC=CO2)SC

Isomeric SMILES

CC1=NN=C(N1NC(=S)NC(=O)C=CC2=CC=CO2)SC

InChI

InChI=1S/C12H13N5O2S2/c1-8-14-15-12(21-2)17(8)16-11(20)13-10(18)6-5-9-4-3-7-19-9/h3-7H,1-2H3,(H2,13,16,18,20)