3-[3-[[(5-methyl-2-phenyl-1,3-thiazol-4-yl)carbonylamino]methyl]-4-propoxy-phenyl]-2-propan-2-yloxy-propanoic acid

Systemtic Name: 3-[3-[[(5-methyl-2-phenyl-1,3-thiazol-4-yl)carbonylamino]methyl]-4-propoxy-phenyl]-2-propan-2-yloxy-propanoic acid Openeye Name: 2-isopropoxy-3-[3-[[(5-methyl-2-phenyl-thiazole-4-carbonyl)amino]methyl]-4-propoxy-phenyl]propanoic acid CAS Name: 3-[3-[[[(5-methyl-2-phenyl-4-thiazolyl)-oxomethyl]amino]methyl]-4-propoxyphenyl]-2-propan-2-yloxypropanoic acid IUPAC Name: 3-[3-[[(5-methyl-2-phenyl-1,3-thiazole-4-carbonyl)amino]methyl]-4-propoxyphenyl]-2-propan-2-yloxypropanoic acid Traditional Name: 2-isopropoxy-3-[3-[[(5-methyl-2-phenyl-thiazole-4-carbonyl)amino]methyl]-4-propoxy-phenyl]propionic acid Formula: C27H32N2O5S MolecularWeight: 496.61838

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=C(C=C(C=C1)CC(C(=O)O)OC(C)C)CNC(=O)C2=C(SC(=N2)C3=CC=CC=C3)C

Isomeric SMILES

CCCOC1=C(C=C(C=C1)CC(C(=O)O)OC(C)C)CNC(=O)C2=C(SC(=N2)C3=CC=CC=C3)C

InChI

InChI=1S/C27H32N2O5S/c1-5-13-33-22-12-11-19(15-23(27(31)32)34-17(2)3)14-21(22)16-28-25(30)24-18(4)35-26(29-24)20-9-7-6-8-10-20/h6-12,14,17,23H,5,13,15-16H2,1-4H3,(H,28,30)(H,31,32)