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

Systemtic Name: 4-[(2-chlorophenyl)diazenyl]-3,5-diphenyl-pyrazole-1-carbothioamide Openeye Name: 4-(2-chlorophenyl)azo-3,5-diphenyl-pyrazole-1-carbothioamide CAS Name: 4-(2-chlorophenyl)azo-3,5-diphenyl-1-pyrazolecarbothioamide IUPAC Name: 4-[(2-chlorophenyl)diazenyl]-3,5-diphenylpyrazole-1-carbothioamide Traditional Name: 4-(2-chlorophenyl)azo-3,5-diphenyl-pyrazole-1-carbothioamide Formula: C22H16ClN5S MolecularWeight: 417.91394

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=C(C(=NN2C(=S)N)C3=CC=CC=C3)N=NC4=CC=CC=C4Cl

Isomeric SMILES

C1=CC=C(C=C1)C2=C(C(=NN2C(=S)N)C3=CC=CC=C3)N=NC4=CC=CC=C4Cl

InChI

InChI=1S/C22H16ClN5S/c23-17-13-7-8-14-18(17)25-26-20-19(15-9-3-1-4-10-15)27-28(22(24)29)21(20)16-11-5-2-6-12-16/h1-14H,(H2,24,29)