3-(5-phenylpyridin-3-yl)-3-[6-[2-(5,6,7,8-tetrahydro-1,8-naphthyridin-2-yl)ethoxy]-1-benzothiophen-3-yl]propanoic acid

Systemtic Name: 3-(5-phenylpyridin-3-yl)-3-[6-[2-(5,6,7,8-tetrahydro-1,8-naphthyridin-2-yl)ethoxy]-1-benzothiophen-3-yl]propanoic acid Openeye Name: 3-(5-phenyl-3-pyridyl)-3-[6-[2-(5,6,7,8-tetrahydro-1,8-naphthyridin-2-yl)ethoxy]benzothiophen-3-yl]propanoic acid CAS Name: 3-(5-phenyl-3-pyridinyl)-3-[6-[2-(5,6,7,8-tetrahydro-1,8-naphthyridin-2-yl)ethoxy]-1-benzothiophen-3-yl]propanoic acid IUPAC Name: 3-(5-phenylpyridin-3-yl)-3-[6-[2-(5,6,7,8-tetrahydro-1,8-naphthyridin-2-yl)ethoxy]-1-benzothiophen-3-yl]propanoic acid Traditional Name: 3-(5-phenyl-3-pyridyl)-3-[6-[2-(5,6,7,8-tetrahydro-1,8-naphthyridin-2-yl)ethoxy]benzothiophen-3-yl]propionic acid Formula: C32H29N3O3S MolecularWeight: 535.65596

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Descriptors Computed from Structure

Canonical SMILES:

C1CC2=C(NC1)N=C(C=C2)CCOC3=CC4=C(C=C3)C(=CS4)C(CC(=O)O)C5=CN=CC(=C5)C6=CC=CC=C6

Isomeric SMILES

C1CC2=C(NC1)N=C(C=C2)CCOC3=CC4=C(C=C3)C(=CS4)C(CC(=O)O)C5=CN=CC(=C5)C6=CC=CC=C6

InChI

InChI=1S/C32H29N3O3S/c36-31(37)17-28(24-15-23(18-33-19-24)21-5-2-1-3-6-21)29-20-39-30-16-26(10-11-27(29)30)38-14-12-25-9-8-22-7-4-13-34-32(22)35-25/h1-3,5-6,8-11,15-16,18-20,28H,4,7,12-14,17H2,(H,34,35)(H,36,37)