4-[(2,6-dimethylphenyl)diazenyl]-3,5-diphenyl-pyrazole-1-carbothioamide

Systemtic Name: 4-[(2,6-dimethylphenyl)diazenyl]-3,5-diphenyl-pyrazole-1-carbothioamide Openeye Name: 4-(2,6-dimethylphenyl)azo-3,5-diphenyl-pyrazole-1-carbothioamide CAS Name: 4-(2,6-dimethylphenyl)azo-3,5-diphenyl-1-pyrazolecarbothioamide IUPAC Name: 4-[(2,6-dimethylphenyl)diazenyl]-3,5-diphenylpyrazole-1-carbothioamide Traditional Name: 4-(2,6-dimethylphenyl)azo-3,5-diphenyl-pyrazole-1-carbothioamide Formula: C24H21N5S MolecularWeight: 411.52204

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)C)N=NC2=C(N(N=C2C3=CC=CC=C3)C(=S)N)C4=CC=CC=C4

Isomeric SMILES

CC1=C(C(=CC=C1)C)N=NC2=C(N(N=C2C3=CC=CC=C3)C(=S)N)C4=CC=CC=C4

InChI

InChI=1S/C24H21N5S/c1-16-10-9-11-17(2)20(16)26-27-22-21(18-12-5-3-6-13-18)28-29(24(25)30)23(22)19-14-7-4-8-15-19/h3-15H,1-2H3,(H2,25,30)