2,2-bis(chloranyl)-N-[2-(2,5-dimethyl-4-nitro-pyrazol-3-yl)sulfanylphenyl]ethanamide

Systemtic Name: 2,2-bis(chloranyl)-N-[2-(2,5-dimethyl-4-nitro-pyrazol-3-yl)sulfanylphenyl]ethanamide Openeye Name: 2,2-dichloro-N-[2-(2,5-dimethyl-4-nitro-pyrazol-3-yl)sulfanylphenyl]acetamide CAS Name: 2,2-dichloro-N-[2-[(2,5-dimethyl-4-nitro-3-pyrazolyl)thio]phenyl]acetamide IUPAC Name: 2,2-dichloro-N-[2-(2,5-dimethyl-4-nitropyrazol-3-yl)sulfanylphenyl]acetamide Traditional Name: 2,2-dichloro-N-[2-[(2,5-dimethyl-4-nitro-pyrazol-3-yl)thio]phenyl]acetamide Formula: C13H12Cl2N4O3S MolecularWeight: 375.23038

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=C1[N+](=O)[O-])SC2=CC=CC=C2NC(=O)C(Cl)Cl)C

Isomeric SMILES

CC1=NN(C(=C1[N+](=O)[O-])SC2=CC=CC=C2NC(=O)C(Cl)Cl)C

InChI

InChI=1S/C13H12Cl2N4O3S/c1-7-10(19(21)22)13(18(2)17-7)23-9-6-4-3-5-8(9)16-12(20)11(14)15/h3-6,11H,1-2H3,(H,16,20)