4-[2-[2-(3,4-dimethoxyphenyl)-1,3-thiazol-4-yl]ethanoylamino]butanoic acid

Systemtic Name: 4-[2-[2-(3,4-dimethoxyphenyl)-1,3-thiazol-4-yl]ethanoylamino]butanoic acid Openeye Name: 4-[[2-[2-(3,4-dimethoxyphenyl)thiazol-4-yl]acetyl]amino]butanoic acid CAS Name: 4-[[2-[2-(3,4-dimethoxyphenyl)-4-thiazolyl]-1-oxoethyl]amino]butanoic acid IUPAC Name: 4-[[2-[2-(3,4-dimethoxyphenyl)-1,3-thiazol-4-yl]acetyl]amino]butanoic acid Traditional Name: 4-[[2-[2-(3,4-dimethoxyphenyl)thiazol-4-yl]acetyl]amino]butyric acid Formula: C17H20N2O5S MolecularWeight: 364.4161

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C2=NC(=CS2)CC(=O)NCCCC(=O)O)OC

Isomeric SMILES

COC1=C(C=C(C=C1)C2=NC(=CS2)CC(=O)NCCCC(=O)O)OC

InChI

InChI=1S/C17H20N2O5S/c1-23-13-6-5-11(8-14(13)24-2)17-19-12(10-25-17)9-15(20)18-7-3-4-16(21)22/h5-6,8,10H,3-4,7,9H2,1-2H3,(H,18,20)(H,21,22)