3-(1,3-diphenylpyrazol-4-yl)-N,5-diphenyl-3,4-dihydropyrazole-2-carbothioamide

Systemtic Name: 3-(1,3-diphenylpyrazol-4-yl)-N,5-diphenyl-3,4-dihydropyrazole-2-carbothioamide Openeye Name: 3-(1,3-diphenylpyrazol-4-yl)-N,5-diphenyl-3,4-dihydropyrazole-2-carbothioamide CAS Name: 3-(1,3-diphenyl-4-pyrazolyl)-N,5-diphenyl-3,4-dihydropyrazole-2-carbothioamide IUPAC Name: 3-(1,3-diphenylpyrazol-4-yl)-N,5-diphenyl-3,4-dihydropyrazole-2-carbothioamide Traditional Name: 5-(1,3-diphenylpyrazol-4-yl)-N,3-diphenyl-2-pyrazoline-1-carbothioamide Formula: C31H25N5S MolecularWeight: 499.6287

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Descriptors Computed from Structure

Canonical SMILES:

C1C(N(N=C1C2=CC=CC=C2)C(=S)NC3=CC=CC=C3)C4=CN(N=C4C5=CC=CC=C5)C6=CC=CC=C6

Isomeric SMILES

C1C(N(N=C1C2=CC=CC=C2)C(=S)NC3=CC=CC=C3)C4=CN(N=C4C5=CC=CC=C5)C6=CC=CC=C6

InChI

InChI=1S/C31H25N5S/c37-31(32-25-17-9-3-10-18-25)36-29(21-28(33-36)23-13-5-1-6-14-23)27-22-35(26-19-11-4-12-20-26)34-30(27)24-15-7-2-8-16-24/h1-20,22,29H,21H2,(H,32,37)