1-[(3R)-3-(furan-2-yl)-5-thiophen-2-yl-3,4-dihydropyrazol-2-yl]-2-[(6-methyl-1H-benzimidazol-2-yl)sulfanyl]ethanone

Systemtic Name: 1-[(3R)-3-(furan-2-yl)-5-thiophen-2-yl-3,4-dihydropyrazol-2-yl]-2-[(6-methyl-1H-benzimidazol-2-yl)sulfanyl]ethanone Openeye Name: 1-[(3R)-3-(2-furyl)-5-(2-thienyl)-3,4-dihydropyrazol-2-yl]-2-[(6-methyl-1H-benzimidazol-2-yl)sulfanyl]ethanone CAS Name: 1-[(3R)-3-(2-furanyl)-5-thiophen-2-yl-3,4-dihydropyrazol-2-yl]-2-[(6-methyl-1H-benzimidazol-2-yl)thio]ethanone IUPAC Name: 1-[(3R)-3-(furan-2-yl)-5-thiophen-2-yl-3,4-dihydropyrazol-2-yl]-2-[(6-methyl-1H-benzimidazol-2-yl)sulfanyl]ethanone Traditional Name: 1-[(5R)-5-(2-furyl)-3-(2-thienyl)-2-pyrazolin-1-yl]-2-[(6-methyl-1H-benzimidazol-2-yl)thio]ethanone Formula: C21H18N4O2S2 MolecularWeight: 422.52322

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)N=C(N2)SCC(=O)N3C(CC(=N3)C4=CC=CS4)C5=CC=CO5

Isomeric SMILES

CC1=CC2=C(C=C1)N=C(N2)SCC(=O)N3[C@H](CC(=N3)C4=CC=CS4)C5=CC=CO5

InChI

InChI=1S/C21H18N4O2S2/c1-13-6-7-14-15(10-13)23-21(22-14)29-12-20(26)25-17(18-4-2-8-27-18)11-16(24-25)19-5-3-9-28-19/h2-10,17H,11-12H2,1H3,(H,22,23)/t17-/m1/s1