2,4-bis(chloranyl)-N-[[(5-methyl-1H-pyrazol-3-yl)carbonylamino]carbamothioyl]benzamide

Systemtic Name: 2,4-bis(chloranyl)-N-[[(5-methyl-1H-pyrazol-3-yl)carbonylamino]carbamothioyl]benzamide Openeye Name: 2,4-dichloro-N-[[(5-methyl-1H-pyrazole-3-carbonyl)amino]carbamothioyl]benzamide CAS Name: 2,4-dichloro-N-[[[(5-methyl-1H-pyrazol-3-yl)-oxomethyl]hydrazo]-sulfanylidenemethyl]benzamide IUPAC Name: 2,4-dichloro-N-[[(5-methyl-1H-pyrazole-3-carbonyl)amino]carbamothioyl]benzamide Traditional Name: 2,4-dichloro-N-[[(5-methyl-1H-pyrazole-3-carbonyl)amino]thiocarbamoyl]benzamide Formula: C13H11Cl2N5O2S MolecularWeight: 372.22974

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NN1)C(=O)NNC(=S)NC(=O)C2=C(C=C(C=C2)Cl)Cl

Isomeric SMILES

CC1=CC(=NN1)C(=O)NNC(=S)NC(=O)C2=C(C=C(C=C2)Cl)Cl

InChI

InChI=1S/C13H11Cl2N5O2S/c1-6-4-10(18-17-6)12(22)19-20-13(23)16-11(21)8-3-2-7(14)5-9(8)15/h2-5H,1H3,(H,17,18)(H,19,22)(H2,16,20,21,23)