(3S)-3,5-bis(4-methoxyphenyl)-N-phenyl-1,3-dihydropyrazole-2-carbothioamide

Systemtic Name: (3S)-3,5-bis(4-methoxyphenyl)-N-phenyl-1,3-dihydropyrazole-2-carbothioamide Openeye Name: (3S)-3,5-bis(4-methoxyphenyl)-N-phenyl-1,3-dihydropyrazole-2-carbothioamide CAS Name: (3S)-3,5-bis(4-methoxyphenyl)-N-phenyl-1,3-dihydropyrazole-2-carbothioamide IUPAC Name: (3S)-3,5-bis(4-methoxyphenyl)-N-phenyl-1,3-dihydropyrazole-2-carbothioamide Traditional Name: (5S)-3,5-bis(4-methoxyphenyl)-N-phenyl-3-pyrazoline-1-carbothioamide Formula: C24H23N3O2S MolecularWeight: 417.52332

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C24H23N3O2S/c1-28-20-12-8-17(9-13-20)22-16-23(18-10-14-21(29-2)15-11-18)27(26-22)24(30)25-19-6-4-3-5-7-19/h3-16,23,26H,1-2H3,(H,25,30)/t23-/m0/s1