3-(2-hydroxyphenyl)-N-(4-methoxyphenyl)-5-phenyl-3,4-dihydropyrazole-2-carbothioamide

Systemtic Name: 3-(2-hydroxyphenyl)-N-(4-methoxyphenyl)-5-phenyl-3,4-dihydropyrazole-2-carbothioamide Openeye Name: 3-(2-hydroxyphenyl)-N-(4-methoxyphenyl)-5-phenyl-3,4-dihydropyrazole-2-carbothioamide CAS Name: 3-(2-hydroxyphenyl)-N-(4-methoxyphenyl)-5-phenyl-3,4-dihydropyrazole-2-carbothioamide IUPAC Name: 3-(2-hydroxyphenyl)-N-(4-methoxyphenyl)-5-phenyl-3,4-dihydropyrazole-2-carbothioamide Traditional Name: 5-(2-hydroxyphenyl)-N-(4-methoxyphenyl)-3-phenyl-2-pyrazoline-1-carbothioamide Formula: C23H21N3O2S MolecularWeight: 403.49674

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)NC(=S)N2C(CC(=N2)C3=CC=CC=C3)C4=CC=CC=C4O

Isomeric SMILES

COC1=CC=C(C=C1)NC(=S)N2C(CC(=N2)C3=CC=CC=C3)C4=CC=CC=C4O

InChI

InChI=1S/C23H21N3O2S/c1-28-18-13-11-17(12-14-18)24-23(29)26-21(19-9-5-6-10-22(19)27)15-20(25-26)16-7-3-2-4-8-16/h2-14,21,27H,15H2,1H3,(H,24,29)