N-[(4-chlorophenyl)carbamothioyl]-1-methyl-pyrazole-3-carboxamide

Systemtic Name: N-[(4-chlorophenyl)carbamothioyl]-1-methyl-pyrazole-3-carboxamide Openeye Name: N-[(4-chlorophenyl)carbamothioyl]-1-methyl-pyrazole-3-carboxamide CAS Name: N-[(4-chloroanilino)-sulfanylidenemethyl]-1-methyl-3-pyrazolecarboxamide IUPAC Name: N-[(4-chlorophenyl)carbamothioyl]-1-methylpyrazole-3-carboxamide Traditional Name: N-[(4-chlorophenyl)thiocarbamoyl]-1-methyl-pyrazole-3-carboxamide Formula: C12H11ClN4OS MolecularWeight: 294.75994

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN1C=CC(=N1)C(=O)NC(=S)NC2=CC=C(C=C2)Cl

Isomeric SMILES

CN1C=CC(=N1)C(=O)NC(=S)NC2=CC=C(C=C2)Cl

InChI

InChI=1S/C12H11ClN4OS/c1-17-7-6-10(16-17)11(18)15-12(19)14-9-4-2-8(13)3-5-9/h2-7H,1H3,(H2,14,15,18,19)