4-[2-[4-(4-fluorophenyl)-2-propan-2-yl-6-thiophen-2-yl-pyridin-3-yl]ethynyl-methoxy-phosphoryl]-3-oxidanyl-butanoic acid

Systemtic Name: 4-[2-[4-(4-fluorophenyl)-2-propan-2-yl-6-thiophen-2-yl-pyridin-3-yl]ethynyl-methoxy-phosphoryl]-3-oxidanyl-butanoic acid Openeye Name: 4-[2-[4-(4-fluorophenyl)-2-isopropyl-6-(2-thienyl)-3-pyridyl]ethynyl-methoxy-phosphoryl]-3-hydroxy-butanoic acid CAS Name: 4-[2-[4-(4-fluorophenyl)-2-propan-2-yl-6-thiophen-2-yl-3-pyridinyl]ethynyl-methoxyphosphoryl]-3-hydroxybutanoic acid IUPAC Name: 4-[2-[4-(4-fluorophenyl)-2-propan-2-yl-6-thiophen-2-ylpyridin-3-yl]ethynyl-methoxyphosphoryl]-3-hydroxybutanoic acid Traditional Name: 4-[2-[4-(4-fluorophenyl)-2-isopropyl-6-(2-thienyl)-3-pyridyl]ethynyl-methoxy-phosphoryl]-3-hydroxy-butyric acid Formula: C25H25FNO5PS MolecularWeight: 501.506864

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=C(C(=CC(=N1)C2=CC=CS2)C3=CC=C(C=C3)F)C#CP(=O)(CC(CC(=O)O)O)OC

Isomeric SMILES

CC(C)C1=C(C(=CC(=N1)C2=CC=CS2)C3=CC=C(C=C3)F)C#CP(=O)(CC(CC(=O)O)O)OC

InChI

InChI=1S/C25H25FNO5PS/c1-16(2)25-20(10-11-33(31,32-3)15-19(28)13-24(29)30)21(17-6-8-18(26)9-7-17)14-22(27-25)23-5-4-12-34-23/h4-9,12,14,16,19,28H,13,15H2,1-3H3,(H,29,30)