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

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

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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