N-[(2,5-dimethylpyrazol-3-yl)methylcarbamothioyl]-2-methyl-pyrazole-3-carboxamide

Systemtic Name: N-[(2,5-dimethylpyrazol-3-yl)methylcarbamothioyl]-2-methyl-pyrazole-3-carboxamide Openeye Name: N-[(2,5-dimethylpyrazol-3-yl)methylcarbamothioyl]-2-methyl-pyrazole-3-carboxamide CAS Name: N-[[(2,5-dimethyl-3-pyrazolyl)methylamino]-sulfanylidenemethyl]-2-methyl-3-pyrazolecarboxamide IUPAC Name: N-[(2,5-dimethylpyrazol-3-yl)methylcarbamothioyl]-2-methylpyrazole-3-carboxamide Traditional Name: N-[(2,5-dimethylpyrazol-3-yl)methylthiocarbamoyl]-2-methyl-pyrazole-3-carboxamide Formula: C12H16N6OS MolecularWeight: 292.36004

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=C1)CNC(=S)NC(=O)C2=CC=NN2C)C

Isomeric SMILES

CC1=NN(C(=C1)CNC(=S)NC(=O)C2=CC=NN2C)C

InChI

InChI=1S/C12H16N6OS/c1-8-6-9(17(2)16-8)7-13-12(20)15-11(19)10-4-5-14-18(10)3/h4-6H,7H2,1-3H3,(H2,13,15,19,20)