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

Systemtic Name: 4-[(2-chlorophenyl)diazenyl]-5-ethoxy-3-methyl-pyrazole-1-carbothioamide Openeye Name: 4-(2-chlorophenyl)azo-5-ethoxy-3-methyl-pyrazole-1-carbothioamide CAS Name: 4-(2-chlorophenyl)azo-5-ethoxy-3-methyl-1-pyrazolecarbothioamide IUPAC Name: 4-[(2-chlorophenyl)diazenyl]-5-ethoxy-3-methylpyrazole-1-carbothioamide Traditional Name: 4-(2-chlorophenyl)azo-5-ethoxy-3-methyl-pyrazole-1-carbothioamide Formula: C13H14ClN5OS MolecularWeight: 323.80116

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C(=NN1C(=S)N)C)N=NC2=CC=CC=C2Cl

Isomeric SMILES

CCOC1=C(C(=NN1C(=S)N)C)N=NC2=CC=CC=C2Cl

InChI

InChI=1S/C13H14ClN5OS/c1-3-20-12-11(8(2)18-19(12)13(15)21)17-16-10-7-5-4-6-9(10)14/h4-7H,3H2,1-2H3,(H2,15,21)