(E)-3-[3-(3H-benzimidazol-5-yloxy)-5,6-dimethoxy-1-benzothiophen-2-yl]-2-pyridin-4-yl-prop-2-enoic acid

Systemtic Name: (E)-3-[3-(3H-benzimidazol-5-yloxy)-5,6-dimethoxy-1-benzothiophen-2-yl]-2-pyridin-4-yl-prop-2-enoic acid Openeye Name: (E)-3-[3-(3H-benzimidazol-5-yloxy)-5,6-dimethoxy-benzothiophen-2-yl]-2-(4-pyridyl)prop-2-enoic acid CAS Name: (E)-3-[3-(3H-benzimidazol-5-yloxy)-5,6-dimethoxy-1-benzothiophen-2-yl]-2-pyridin-4-yl-2-propenoic acid IUPAC Name: (E)-3-[3-(3H-benzimidazol-5-yloxy)-5,6-dimethoxy-1-benzothiophen-2-yl]-2-pyridin-4-ylprop-2-enoic acid Traditional Name: (E)-3-[3-(3H-benzimidazol-5-yloxy)-5,6-dimethoxy-benzothiophen-2-yl]-2-(4-pyridyl)acrylic acid Formula: C25H19N3O5S MolecularWeight: 473.50046

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C2C(=C1)C(=C(S2)C=C(C3=CC=NC=C3)C(=O)O)OC4=CC5=C(C=C4)N=CN5)OC

Isomeric SMILES

COC1=C(C=C2C(=C1)C(=C(S2)/C=C(\C3=CC=NC=C3)/C(=O)O)OC4=CC5=C(C=C4)N=CN5)OC

InChI

InChI=1S/C25H19N3O5S/c1-31-20-10-17-22(12-21(20)32-2)34-23(11-16(25(29)30)14-5-7-26-8-6-14)24(17)33-15-3-4-18-19(9-15)28-13-27-18/h3-13H,1-2H3,(H,27,28)(H,29,30)/b16-11+