2-[3,5-dimethyl-1-(4-nitrophenyl)pyrazol-4-yl]sulfanylaniline

Systemtic Name: 2-[3,5-dimethyl-1-(4-nitrophenyl)pyrazol-4-yl]sulfanylaniline Openeye Name: 2-[3,5-dimethyl-1-(4-nitrophenyl)pyrazol-4-yl]sulfanylaniline CAS Name: 2-[[3,5-dimethyl-1-(4-nitrophenyl)-4-pyrazolyl]thio]aniline IUPAC Name: 2-[3,5-dimethyl-1-(4-nitrophenyl)pyrazol-4-yl]sulfanylaniline Traditional Name: [2-[[3,5-dimethyl-1-(4-nitrophenyl)pyrazol-4-yl]thio]phenyl]amine Formula: C17H16N4O2S MolecularWeight: 340.39954

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1C2=CC=C(C=C2)[N+](=O)[O-])C)SC3=CC=CC=C3N

Isomeric SMILES

CC1=C(C(=NN1C2=CC=C(C=C2)[N+](=O)[O-])C)SC3=CC=CC=C3N

InChI

InChI=1S/C17H16N4O2S/c1-11-17(24-16-6-4-3-5-15(16)18)12(2)20(19-11)13-7-9-14(10-8-13)21(22)23/h3-10H,18H2,1-2H3