(3S)-3-(2,5-dimethoxyphenyl)-N,5-diphenyl-1,3-dihydropyrazole-2-carbothioamide

Systemtic Name: (3S)-3-(2,5-dimethoxyphenyl)-N,5-diphenyl-1,3-dihydropyrazole-2-carbothioamide Openeye Name: (3S)-3-(2,5-dimethoxyphenyl)-N,5-diphenyl-1,3-dihydropyrazole-2-carbothioamide CAS Name: (3S)-3-(2,5-dimethoxyphenyl)-N,5-diphenyl-1,3-dihydropyrazole-2-carbothioamide IUPAC Name: (3S)-3-(2,5-dimethoxyphenyl)-N,5-diphenyl-1,3-dihydropyrazole-2-carbothioamide Traditional Name: (5S)-5-(2,5-dimethoxyphenyl)-N,3-diphenyl-3-pyrazoline-1-carbothioamide Formula: C24H23N3O2S MolecularWeight: 417.52332

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1)OC)C2C=C(NN2C(=S)NC3=CC=CC=C3)C4=CC=CC=C4

Isomeric SMILES

COC1=CC(=C(C=C1)OC)[C@@H]2C=C(NN2C(=S)NC3=CC=CC=C3)C4=CC=CC=C4

InChI

InChI=1S/C24H23N3O2S/c1-28-19-13-14-23(29-2)20(15-19)22-16-21(17-9-5-3-6-10-17)26-27(22)24(30)25-18-11-7-4-8-12-18/h3-16,22,26H,1-2H3,(H,25,30)/t22-/m0/s1