S-(2,4-dichlorophenyl) 2,5-dimethyl-4-nitro-pyrazole-3-carbothioate

Systemtic Name: S-(2,4-dichlorophenyl) 2,5-dimethyl-4-nitro-pyrazole-3-carbothioate Openeye Name: S-(2,4-dichlorophenyl) 2,5-dimethyl-4-nitro-pyrazole-3-carbothioate CAS Name: 2,5-dimethyl-4-nitro-3-pyrazolecarbothioic acid S-(2,4-dichlorophenyl) ester IUPAC Name: S-(2,4-dichlorophenyl) 2,5-dimethyl-4-nitropyrazole-3-carbothioate Traditional Name: 2,5-dimethyl-4-nitro-pyrazole-3-carbothioic acid S-(2,4-dichlorophenyl) ester Formula: C12H9Cl2N3O3S MolecularWeight: 346.18916

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=C1[N+](=O)[O-])C(=O)SC2=C(C=C(C=C2)Cl)Cl)C

Isomeric SMILES

CC1=NN(C(=C1[N+](=O)[O-])C(=O)SC2=C(C=C(C=C2)Cl)Cl)C

InChI

InChI=1S/C12H9Cl2N3O3S/c1-6-10(17(19)20)11(16(2)15-6)12(18)21-9-4-3-7(13)5-8(9)14/h3-5H,1-2H3