1-[(3R)-3,5-dithiophen-2-yl-3,4-dihydropyrazol-2-yl]-2-(1-methylbenzimidazol-2-yl)sulfanyl-ethanone

Systemtic Name: 1-[(3R)-3,5-dithiophen-2-yl-3,4-dihydropyrazol-2-yl]-2-(1-methylbenzimidazol-2-yl)sulfanyl-ethanone Openeye Name: 1-[(3R)-3,5-bis(2-thienyl)-3,4-dihydropyrazol-2-yl]-2-(1-methylbenzimidazol-2-yl)sulfanyl-ethanone CAS Name: 1-[(3R)-3,5-dithiophen-2-yl-3,4-dihydropyrazol-2-yl]-2-[(1-methyl-2-benzimidazolyl)thio]ethanone IUPAC Name: 1-[(3R)-3,5-dithiophen-2-yl-3,4-dihydropyrazol-2-yl]-2-(1-methylbenzimidazol-2-yl)sulfanylethanone Traditional Name: 1-[(5R)-3,5-bis(2-thienyl)-2-pyrazolin-1-yl]-2-[(1-methylbenzimidazol-2-yl)thio]ethanone Formula: C21H18N4OS3 MolecularWeight: 438.58882

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=CC=CC=C2N=C1SCC(=O)N3C(CC(=N3)C4=CC=CS4)C5=CC=CS5

Isomeric SMILES

CN1C2=CC=CC=C2N=C1SCC(=O)N3[C@H](CC(=N3)C4=CC=CS4)C5=CC=CS5

InChI

InChI=1S/C21H18N4OS3/c1-24-16-7-3-2-6-14(16)22-21(24)29-13-20(26)25-17(19-9-5-11-28-19)12-15(23-25)18-8-4-10-27-18/h2-11,17H,12-13H2,1H3/t17-/m1/s1