2-(2,5-dimethyl-4-nitro-pyrazol-3-yl)sulfanylaniline

Systemtic Name: 2-(2,5-dimethyl-4-nitro-pyrazol-3-yl)sulfanylaniline Openeye Name: 2-(2,5-dimethyl-4-nitro-pyrazol-3-yl)sulfanylaniline CAS Name: 2-[(2,5-dimethyl-4-nitro-3-pyrazolyl)thio]aniline IUPAC Name: 2-(2,5-dimethyl-4-nitropyrazol-3-yl)sulfanylaniline Traditional Name: [2-[(2,5-dimethyl-4-nitro-pyrazol-3-yl)thio]phenyl]amine Formula: C11H12N4O2S MolecularWeight: 264.30358

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=C1[N+](=O)[O-])SC2=CC=CC=C2N)C

Isomeric SMILES

CC1=NN(C(=C1[N+](=O)[O-])SC2=CC=CC=C2N)C

InChI

InChI=1S/C11H12N4O2S/c1-7-10(15(16)17)11(14(2)13-7)18-9-6-4-3-5-8(9)12/h3-6H,12H2,1-2H3