5-phenyl-3-(4-phenylmethoxyphenyl)-3,4-dihydropyrazole-2-carbothioamide

Systemtic Name: 5-phenyl-3-(4-phenylmethoxyphenyl)-3,4-dihydropyrazole-2-carbothioamide Openeye Name: 3-(4-benzyloxyphenyl)-5-phenyl-3,4-dihydropyrazole-2-carbothioamide CAS Name: 5-phenyl-3-(4-phenylmethoxyphenyl)-3,4-dihydropyrazole-2-carbothioamide IUPAC Name: 5-phenyl-3-(4-phenylmethoxyphenyl)-3,4-dihydropyrazole-2-carbothioamide Traditional Name: 5-(4-benzoxyphenyl)-3-phenyl-2-pyrazoline-1-carbothioamide Formula: C23H21N3OS MolecularWeight: 387.49734

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Descriptors Computed from Structure

Canonical SMILES:

C1C(N(N=C1C2=CC=CC=C2)C(=S)N)C3=CC=C(C=C3)OCC4=CC=CC=C4

Isomeric SMILES

C1C(N(N=C1C2=CC=CC=C2)C(=S)N)C3=CC=C(C=C3)OCC4=CC=CC=C4

InChI

InChI=1S/C23H21N3OS/c24-23(28)26-22(15-21(25-26)18-9-5-2-6-10-18)19-11-13-20(14-12-19)27-16-17-7-3-1-4-8-17/h1-14,22H,15-16H2,(H2,24,28)