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

Systemtic Name: (E)-3-[5,6-dimethoxy-3-[(4-methoxyphenyl)amino]-1-benzothiophen-2-yl]-2-pyridin-4-yl-prop-2-enoic acid Openeye Name: (E)-3-[5,6-dimethoxy-3-(4-methoxyanilino)benzothiophen-2-yl]-2-(4-pyridyl)prop-2-enoic acid CAS Name: (E)-3-[5,6-dimethoxy-3-(4-methoxyanilino)-1-benzothiophen-2-yl]-2-pyridin-4-yl-2-propenoic acid IUPAC Name: (E)-3-[5,6-dimethoxy-3-(4-methoxyanilino)-1-benzothiophen-2-yl]-2-pyridin-4-ylprop-2-enoic acid Traditional Name: (E)-3-[5,6-dimethoxy-3-(p-anisidino)benzothiophen-2-yl]-2-(4-pyridyl)acrylic acid Formula: C25H22N2O5S MolecularWeight: 462.51758

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)NC2=C(SC3=CC(=C(C=C32)OC)OC)C=C(C4=CC=NC=C4)C(=O)O

Isomeric SMILES

COC1=CC=C(C=C1)NC2=C(SC3=CC(=C(C=C32)OC)OC)/C=C(\C4=CC=NC=C4)/C(=O)O

InChI

InChI=1S/C25H22N2O5S/c1-30-17-6-4-16(5-7-17)27-24-19-12-20(31-2)21(32-3)14-22(19)33-23(24)13-18(25(28)29)15-8-10-26-11-9-15/h4-14,27H,1-3H3,(H,28,29)/b18-13+