N-[[(2-methylpyrazol-3-yl)carbonylamino]carbamothioyl]pyridine-3-carboxamide

Systemtic Name: N-[[(2-methylpyrazol-3-yl)carbonylamino]carbamothioyl]pyridine-3-carboxamide Openeye Name: N-[[(2-methylpyrazole-3-carbonyl)amino]carbamothioyl]pyridine-3-carboxamide CAS Name: N-[[[(2-methyl-3-pyrazolyl)-oxomethyl]hydrazo]-sulfanylidenemethyl]-3-pyridinecarboxamide IUPAC Name: N-[[(2-methylpyrazole-3-carbonyl)amino]carbamothioyl]pyridine-3-carboxamide Traditional Name: N-[[(2-methylpyrazole-3-carbonyl)amino]thiocarbamoyl]nicotinamide Formula: C12H12N6O2S MolecularWeight: 304.32768

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=CC=N1)C(=O)NNC(=S)NC(=O)C2=CN=CC=C2

Isomeric SMILES

CN1C(=CC=N1)C(=O)NNC(=S)NC(=O)C2=CN=CC=C2

InChI

InChI=1S/C12H12N6O2S/c1-18-9(4-6-14-18)11(20)16-17-12(21)15-10(19)8-3-2-5-13-7-8/h2-7H,1H3,(H,16,20)(H2,15,17,19,21)