4-(4-methyl-1,3-thiazol-2-yl)-4-oxidanyl-5-oxidanylidene-1-(phenylmethyl)pyrrolidine-3-carboxylic acid

Systemtic Name: 4-(4-methyl-1,3-thiazol-2-yl)-4-oxidanyl-5-oxidanylidene-1-(phenylmethyl)pyrrolidine-3-carboxylic acid Openeye Name: 1-benzyl-4-hydroxy-4-(4-methylthiazol-2-yl)-5-oxo-pyrrolidine-3-carboxylic acid CAS Name: 4-hydroxy-4-(4-methyl-2-thiazolyl)-5-oxo-1-(phenylmethyl)-3-pyrrolidinecarboxylic acid IUPAC Name: 1-benzyl-4-hydroxy-4-(4-methyl-1,3-thiazol-2-yl)-5-oxopyrrolidine-3-carboxylic acid Traditional Name: 1-benzyl-4-hydroxy-5-keto-4-(4-methylthiazol-2-yl)pyrrolidine-3-carboxylic acid Formula: C16H16N2O4S MolecularWeight: 332.37424

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CSC(=N1)C2(C(CN(C2=O)CC3=CC=CC=C3)C(=O)O)O

Isomeric SMILES

CC1=CSC(=N1)C2(C(CN(C2=O)CC3=CC=CC=C3)C(=O)O)O

InChI

InChI=1S/C16H16N2O4S/c1-10-9-23-14(17-10)16(22)12(13(19)20)8-18(15(16)21)7-11-5-3-2-4-6-11/h2-6,9,12,22H,7-8H2,1H3,(H,19,20)