4-[2-(3,4-dimethoxyphenyl)ethyl-(4-phenyl-1,3-thiazol-2-yl)amino]-4-oxidanylidene-butanoic acid

Systemtic Name: 4-[2-(3,4-dimethoxyphenyl)ethyl-(4-phenyl-1,3-thiazol-2-yl)amino]-4-oxidanylidene-butanoic acid Openeye Name: 4-[2-(3,4-dimethoxyphenyl)ethyl-(4-phenylthiazol-2-yl)amino]-4-oxo-butanoic acid CAS Name: 4-[2-(3,4-dimethoxyphenyl)ethyl-(4-phenyl-2-thiazolyl)amino]-4-oxobutanoic acid IUPAC Name: 4-[2-(3,4-dimethoxyphenyl)ethyl-(4-phenyl-1,3-thiazol-2-yl)amino]-4-oxobutanoic acid Traditional Name: 4-[homoveratryl-(4-phenylthiazol-2-yl)amino]-4-keto-butyric acid Formula: C23H24N2O5S MolecularWeight: 440.51206

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)CCN(C2=NC(=CS2)C3=CC=CC=C3)C(=O)CCC(=O)O)OC

Isomeric SMILES

COC1=C(C=C(C=C1)CCN(C2=NC(=CS2)C3=CC=CC=C3)C(=O)CCC(=O)O)OC

InChI

InChI=1S/C23H24N2O5S/c1-29-19-9-8-16(14-20(19)30-2)12-13-25(21(26)10-11-22(27)28)23-24-18(15-31-23)17-6-4-3-5-7-17/h3-9,14-15H,10-13H2,1-2H3,(H,27,28)