5-ethoxy-3-methyl-4-[(2-nitrophenyl)diazenyl]pyrazole-1-carbothioamide

Systemtic Name: 5-ethoxy-3-methyl-4-[(2-nitrophenyl)diazenyl]pyrazole-1-carbothioamide Openeye Name: 5-ethoxy-3-methyl-4-(2-nitrophenyl)azo-pyrazole-1-carbothioamide CAS Name: 5-ethoxy-3-methyl-4-(2-nitrophenyl)azo-1-pyrazolecarbothioamide IUPAC Name: 5-ethoxy-3-methyl-4-[(2-nitrophenyl)diazenyl]pyrazole-1-carbothioamide Traditional Name: 5-ethoxy-3-methyl-4-(2-nitrophenyl)azo-pyrazole-1-carbothioamide Formula: C13H14N6O3S MolecularWeight: 334.35366

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C(=NN1C(=S)N)C)N=NC2=CC=CC=C2[N+](=O)[O-]

Isomeric SMILES

CCOC1=C(C(=NN1C(=S)N)C)N=NC2=CC=CC=C2[N+](=O)[O-]

InChI

InChI=1S/C13H14N6O3S/c1-3-22-12-11(8(2)17-18(12)13(14)23)16-15-9-6-4-5-7-10(9)19(20)21/h4-7H,3H2,1-2H3,(H2,14,23)