N-(2-methoxy-4-nitro-phenyl)-4-methyl-pyrazole-1-carbothioamide

Systemtic Name: N-(2-methoxy-4-nitro-phenyl)-4-methyl-pyrazole-1-carbothioamide Openeye Name: N-(2-methoxy-4-nitro-phenyl)-4-methyl-pyrazole-1-carbothioamide CAS Name: N-(2-methoxy-4-nitrophenyl)-4-methyl-1-pyrazolecarbothioamide IUPAC Name: N-(2-methoxy-4-nitrophenyl)-4-methylpyrazole-1-carbothioamide Traditional Name: N-(2-methoxy-4-nitro-phenyl)-4-methyl-pyrazole-1-carbothioamide Formula: C12H12N4O3S MolecularWeight: 292.31368

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CN(N=C1)C(=S)NC2=C(C=C(C=C2)[N+](=O)[O-])OC

Isomeric SMILES

CC1=CN(N=C1)C(=S)NC2=C(C=C(C=C2)[N+](=O)[O-])OC

InChI

InChI=1S/C12H12N4O3S/c1-8-6-13-15(7-8)12(20)14-10-4-3-9(16(17)18)5-11(10)19-2/h3-7H,1-2H3,(H,14,20)