4-chloranyl-N-[(2,4-dimethyl-6-nitro-phenyl)carbamothioyl]-2,5-dimethyl-pyrazole-3-carboxamide

Systemtic Name: 4-chloranyl-N-[(2,4-dimethyl-6-nitro-phenyl)carbamothioyl]-2,5-dimethyl-pyrazole-3-carboxamide Openeye Name: 4-chloro-N-[(2,4-dimethyl-6-nitro-phenyl)carbamothioyl]-2,5-dimethyl-pyrazole-3-carboxamide CAS Name: 4-chloro-N-[(2,4-dimethyl-6-nitroanilino)-sulfanylidenemethyl]-2,5-dimethyl-3-pyrazolecarboxamide IUPAC Name: 4-chloro-N-[(2,4-dimethyl-6-nitrophenyl)carbamothioyl]-2,5-dimethylpyrazole-3-carboxamide Traditional Name: 4-chloro-N-[(2,4-dimethyl-6-nitro-phenyl)thiocarbamoyl]-2,5-dimethyl-pyrazole-3-carboxamide Formula: C15H16ClN5O3S MolecularWeight: 381.83724

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C(=C1)[N+](=O)[O-])NC(=S)NC(=O)C2=C(C(=NN2C)C)Cl)C

Isomeric SMILES

CC1=CC(=C(C(=C1)[N+](=O)[O-])NC(=S)NC(=O)C2=C(C(=NN2C)C)Cl)C

InChI

InChI=1S/C15H16ClN5O3S/c1-7-5-8(2)12(10(6-7)21(23)24)17-15(25)18-14(22)13-11(16)9(3)19-20(13)4/h5-6H,1-4H3,(H2,17,18,22,25)