(3R)-3-(2-methoxyphenyl)-N,5-diphenyl-3,4-dihydropyrazole-2-carbothioamide

Systemtic Name: (3R)-3-(2-methoxyphenyl)-N,5-diphenyl-3,4-dihydropyrazole-2-carbothioamide Openeye Name: (3R)-3-(2-methoxyphenyl)-N,5-diphenyl-3,4-dihydropyrazole-2-carbothioamide CAS Name: (3R)-3-(2-methoxyphenyl)-N,5-diphenyl-3,4-dihydropyrazole-2-carbothioamide IUPAC Name: (3R)-3-(2-methoxyphenyl)-N,5-diphenyl-3,4-dihydropyrazole-2-carbothioamide Traditional Name: (5R)-5-(2-methoxyphenyl)-N,3-diphenyl-2-pyrazoline-1-carbothioamide Formula: C23H21N3OS MolecularWeight: 387.49734

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC=C1C2CC(=NN2C(=S)NC3=CC=CC=C3)C4=CC=CC=C4

Isomeric SMILES

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

InChI

InChI=1S/C23H21N3OS/c1-27-22-15-9-8-14-19(22)21-16-20(17-10-4-2-5-11-17)25-26(21)23(28)24-18-12-6-3-7-13-18/h2-15,21H,16H2,1H3,(H,24,28)/t21-/m1/s1