2-(benzimidazol-1-yl)-1-[3-(3,4-dimethoxyphenyl)-5-thiophen-2-yl-3,4-dihydropyrazol-2-yl]ethanone

Systemtic Name: 2-(benzimidazol-1-yl)-1-[3-(3,4-dimethoxyphenyl)-5-thiophen-2-yl-3,4-dihydropyrazol-2-yl]ethanone Openeye Name: 2-(benzimidazol-1-yl)-1-[3-(3,4-dimethoxyphenyl)-5-(2-thienyl)-3,4-dihydropyrazol-2-yl]ethanone CAS Name: 2-(1-benzimidazolyl)-1-[3-(3,4-dimethoxyphenyl)-5-thiophen-2-yl-3,4-dihydropyrazol-2-yl]ethanone IUPAC Name: 2-(benzimidazol-1-yl)-1-[3-(3,4-dimethoxyphenyl)-5-thiophen-2-yl-3,4-dihydropyrazol-2-yl]ethanone Traditional Name: 2-(benzimidazol-1-yl)-1-[5-(3,4-dimethoxyphenyl)-3-(2-thienyl)-2-pyrazolin-1-yl]ethanone Formula: C24H22N4O3S MolecularWeight: 446.52148

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C2CC(=NN2C(=O)CN3C=NC4=CC=CC=C43)C5=CC=CS5)OC

Isomeric SMILES

COC1=C(C=C(C=C1)C2CC(=NN2C(=O)CN3C=NC4=CC=CC=C43)C5=CC=CS5)OC

InChI

InChI=1S/C24H22N4O3S/c1-30-21-10-9-16(12-22(21)31-2)20-13-18(23-8-5-11-32-23)26-28(20)24(29)14-27-15-25-17-6-3-4-7-19(17)27/h3-12,15,20H,13-14H2,1-2H3