3-[2,5-dimethyl-3-(2-methyl-1,3-thiazol-4-yl)pyrrol-1-yl]propanoic acid

Systemtic Name: 3-[2,5-dimethyl-3-(2-methyl-1,3-thiazol-4-yl)pyrrol-1-yl]propanoic acid Openeye Name: 3-[2,5-dimethyl-3-(2-methylthiazol-4-yl)pyrrol-1-yl]propanoic acid CAS Name: 3-[2,5-dimethyl-3-(2-methyl-4-thiazolyl)-1-pyrrolyl]propanoic acid IUPAC Name: 3-[2,5-dimethyl-3-(2-methyl-1,3-thiazol-4-yl)pyrrol-1-yl]propanoic acid Traditional Name: 3-[2,5-dimethyl-3-(2-methylthiazol-4-yl)pyrrol-1-yl]propionic acid Formula: C13H16N2O2S MolecularWeight: 264.34334

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(N1CCC(=O)O)C)C2=CSC(=N2)C

Isomeric SMILES

CC1=CC(=C(N1CCC(=O)O)C)C2=CSC(=N2)C

InChI

InChI=1S/C13H16N2O2S/c1-8-6-11(12-7-18-10(3)14-12)9(2)15(8)5-4-13(16)17/h6-7H,4-5H2,1-3H3,(H,16,17)