3-(3,4-dimethoxyphenyl)-5-[(4-methyl-1,3-thiazol-2-yl)amino]-5-oxidanylidene-pentanoic acid

Systemtic Name: 3-(3,4-dimethoxyphenyl)-5-[(4-methyl-1,3-thiazol-2-yl)amino]-5-oxidanylidene-pentanoic acid Openeye Name: 3-(3,4-dimethoxyphenyl)-5-[(4-methylthiazol-2-yl)amino]-5-oxo-pentanoic acid CAS Name: 3-(3,4-dimethoxyphenyl)-5-[(4-methyl-2-thiazolyl)amino]-5-oxopentanoic acid IUPAC Name: 3-(3,4-dimethoxyphenyl)-5-[(4-methyl-1,3-thiazol-2-yl)amino]-5-oxopentanoic acid Traditional Name: 3-(3,4-dimethoxyphenyl)-5-keto-5-[(4-methylthiazol-2-yl)amino]valeric acid Formula: C17H20N2O5S MolecularWeight: 364.4161

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CSC(=N1)NC(=O)CC(CC(=O)O)C2=CC(=C(C=C2)OC)OC

Isomeric SMILES

CC1=CSC(=N1)NC(=O)CC(CC(=O)O)C2=CC(=C(C=C2)OC)OC

InChI

InChI=1S/C17H20N2O5S/c1-10-9-25-17(18-10)19-15(20)7-12(8-16(21)22)11-4-5-13(23-2)14(6-11)24-3/h4-6,9,12H,7-8H2,1-3H3,(H,21,22)(H,18,19,20)