2-(1H-benzimidazol-2-ylsulfanyl)-1-[(3R)-3,5-bis(4-methoxyphenyl)-3,4-dihydropyrazol-2-yl]ethanone

Systemtic Name: 2-(1H-benzimidazol-2-ylsulfanyl)-1-[(3R)-3,5-bis(4-methoxyphenyl)-3,4-dihydropyrazol-2-yl]ethanone Openeye Name: 2-(1H-benzimidazol-2-ylsulfanyl)-1-[(3R)-3,5-bis(4-methoxyphenyl)-3,4-dihydropyrazol-2-yl]ethanone CAS Name: 2-(1H-benzimidazol-2-ylthio)-1-[(3R)-3,5-bis(4-methoxyphenyl)-3,4-dihydropyrazol-2-yl]ethanone IUPAC Name: 2-(1H-benzimidazol-2-ylsulfanyl)-1-[(3R)-3,5-bis(4-methoxyphenyl)-3,4-dihydropyrazol-2-yl]ethanone Traditional Name: 2-(1H-benzimidazol-2-ylthio)-1-[(5R)-3,5-bis(4-methoxyphenyl)-2-pyrazolin-1-yl]ethanone Formula: C26H24N4O3S MolecularWeight: 472.55876

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C2CC(=NN2C(=O)CSC3=NC4=CC=CC=C4N3)C5=CC=C(C=C5)OC

Isomeric SMILES

COC1=CC=C(C=C1)[C@H]2CC(=NN2C(=O)CSC3=NC4=CC=CC=C4N3)C5=CC=C(C=C5)OC

InChI

InChI=1S/C26H24N4O3S/c1-32-19-11-7-17(8-12-19)23-15-24(18-9-13-20(33-2)14-10-18)30(29-23)25(31)16-34-26-27-21-5-3-4-6-22(21)28-26/h3-14,24H,15-16H2,1-2H3,(H,27,28)/t24-/m1/s1