3-[5-methoxy-1-[5-(6-phenylmethoxypyridin-3-yl)thiophen-2-yl]sulfonyl-indol-3-yl]propanoic acid

Systemtic Name: 3-[5-methoxy-1-[5-(6-phenylmethoxypyridin-3-yl)thiophen-2-yl]sulfonyl-indol-3-yl]propanoic acid Openeye Name: 3-[1-[[5-(6-benzyloxy-3-pyridyl)-2-thienyl]sulfonyl]-5-methoxy-indol-3-yl]propanoic acid CAS Name: 3-[5-methoxy-1-[[5-(6-phenylmethoxy-3-pyridinyl)-2-thiophenyl]sulfonyl]-3-indolyl]propanoic acid IUPAC Name: 3-[5-methoxy-1-[5-(6-phenylmethoxypyridin-3-yl)thiophen-2-yl]sulfonylindol-3-yl]propanoic acid Traditional Name: 3-[1-[[5-(6-benzoxy-3-pyridyl)-2-thienyl]sulfonyl]-5-methoxy-indol-3-yl]propionic acid Formula: C28H24N2O6S2 MolecularWeight: 548.62996

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC2=C(C=C1)N(C=C2CCC(=O)O)S(=O)(=O)C3=CC=C(S3)C4=CN=C(C=C4)OCC5=CC=CC=C5

Isomeric SMILES

COC1=CC2=C(C=C1)N(C=C2CCC(=O)O)S(=O)(=O)C3=CC=C(S3)C4=CN=C(C=C4)OCC5=CC=CC=C5

InChI

InChI=1S/C28H24N2O6S2/c1-35-22-9-10-24-23(15-22)21(8-13-27(31)32)17-30(24)38(33,34)28-14-11-25(37-28)20-7-12-26(29-16-20)36-18-19-5-3-2-4-6-19/h2-7,9-12,14-17H,8,13,18H2,1H3,(H,31,32)