5-methyl-1-(4-nitrophenyl)-N-phenyl-pyrazole-4-carbothioamide

Systemtic Name: 5-methyl-1-(4-nitrophenyl)-N-phenyl-pyrazole-4-carbothioamide Openeye Name: 5-methyl-1-(4-nitrophenyl)-N-phenyl-pyrazole-4-carbothioamide CAS Name: 5-methyl-1-(4-nitrophenyl)-N-phenyl-4-pyrazolecarbothioamide IUPAC Name: 5-methyl-1-(4-nitrophenyl)-N-phenylpyrazole-4-carbothioamide Traditional Name: 5-methyl-1-(4-nitrophenyl)-N-phenyl-pyrazole-4-carbothioamide Formula: C17H14N4O2S MolecularWeight: 338.38366

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=NN1C2=CC=C(C=C2)[N+](=O)[O-])C(=S)NC3=CC=CC=C3

Isomeric SMILES

CC1=C(C=NN1C2=CC=C(C=C2)[N+](=O)[O-])C(=S)NC3=CC=CC=C3

InChI

InChI=1S/C17H14N4O2S/c1-12-16(17(24)19-13-5-3-2-4-6-13)11-18-20(12)14-7-9-15(10-8-14)21(22)23/h2-11H,1H3,(H,19,24)