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

Systemtic Name: N-[(3-bromophenyl)carbamothioyl]-1-methyl-pyrazole-3-carboxamide Openeye Name: N-[(3-bromophenyl)carbamothioyl]-1-methyl-pyrazole-3-carboxamide CAS Name: N-[(3-bromoanilino)-sulfanylidenemethyl]-1-methyl-3-pyrazolecarboxamide IUPAC Name: N-[(3-bromophenyl)carbamothioyl]-1-methylpyrazole-3-carboxamide Traditional Name: N-[(3-bromophenyl)thiocarbamoyl]-1-methyl-pyrazole-3-carboxamide Formula: C12H11BrN4OS MolecularWeight: 339.21094

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H11BrN4OS/c1-17-6-5-10(16-17)11(18)15-12(19)14-9-4-2-3-8(13)7-9/h2-7H,1H3,(H2,14,15,18,19)