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

Systemtic Name: 1-[3-(3,4-dimethoxyphenyl)-5-thiophen-2-yl-3,4-dihydropyrazol-2-yl]-2-(2-pyridin-4-ylbenzimidazol-1-yl)ethanone Openeye Name: 1-[3-(3,4-dimethoxyphenyl)-5-(2-thienyl)-3,4-dihydropyrazol-2-yl]-2-[2-(4-pyridyl)benzimidazol-1-yl]ethanone CAS Name: 1-[3-(3,4-dimethoxyphenyl)-5-thiophen-2-yl-3,4-dihydropyrazol-2-yl]-2-(2-pyridin-4-yl-1-benzimidazolyl)ethanone IUPAC Name: 1-[3-(3,4-dimethoxyphenyl)-5-thiophen-2-yl-3,4-dihydropyrazol-2-yl]-2-(2-pyridin-4-ylbenzimidazol-1-yl)ethanone Traditional Name: 1-[5-(3,4-dimethoxyphenyl)-3-(2-thienyl)-2-pyrazolin-1-yl]-2-[2-(4-pyridyl)benzimidazol-1-yl]ethanone Formula: C29H25N5O3S MolecularWeight: 523.6055

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C2CC(=NN2C(=O)CN3C4=CC=CC=C4N=C3C5=CC=NC=C5)C6=CC=CS6)OC

Isomeric SMILES

COC1=C(C=C(C=C1)C2CC(=NN2C(=O)CN3C4=CC=CC=C4N=C3C5=CC=NC=C5)C6=CC=CS6)OC

InChI

InChI=1S/C29H25N5O3S/c1-36-25-10-9-20(16-26(25)37-2)24-17-22(27-8-5-15-38-27)32-34(24)28(35)18-33-23-7-4-3-6-21(23)31-29(33)19-11-13-30-14-12-19/h3-16,24H,17-18H2,1-2H3