1-[1-[4-(2-methyl-1,3-thiazol-4-yl)phenyl]ethyl]-5-oxidanylidene-pyrrolidine-3-carboxylic acid

Systemtic Name: 1-[1-[4-(2-methyl-1,3-thiazol-4-yl)phenyl]ethyl]-5-oxidanylidene-pyrrolidine-3-carboxylic acid Openeye Name: 1-[1-[4-(2-methylthiazol-4-yl)phenyl]ethyl]-5-oxo-pyrrolidine-3-carboxylic acid CAS Name: 1-[1-[4-(2-methyl-4-thiazolyl)phenyl]ethyl]-5-oxo-3-pyrrolidinecarboxylic acid IUPAC Name: 1-[1-[4-(2-methyl-1,3-thiazol-4-yl)phenyl]ethyl]-5-oxopyrrolidine-3-carboxylic acid Traditional Name: 5-keto-1-[1-[4-(2-methylthiazol-4-yl)phenyl]ethyl]pyrrolidine-3-carboxylic acid Formula: C17H18N2O3S MolecularWeight: 330.40142

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=CS1)C2=CC=C(C=C2)C(C)N3CC(CC3=O)C(=O)O

Isomeric SMILES

CC1=NC(=CS1)C2=CC=C(C=C2)C(C)N3CC(CC3=O)C(=O)O

InChI

InChI=1S/C17H18N2O3S/c1-10(19-8-14(17(21)22)7-16(19)20)12-3-5-13(6-4-12)15-9-23-11(2)18-15/h3-6,9-10,14H,7-8H2,1-2H3,(H,21,22)