2-[4,5-dimethyl-2-(4-methylphenyl)carbonylimino-1,3-thiazol-3-yl]butanoic acid

Systemtic Name: 2-[4,5-dimethyl-2-(4-methylphenyl)carbonylimino-1,3-thiazol-3-yl]butanoic acid Openeye Name: 2-[4,5-dimethyl-2-(4-methylbenzoyl)imino-thiazol-3-yl]butanoic acid CAS Name: 2-[4,5-dimethyl-2-[(4-methylphenyl)-oxomethyl]imino-3-thiazolyl]butanoic acid IUPAC Name: 2-[4,5-dimethyl-2-(4-methylbenzoyl)imino-1,3-thiazol-3-yl]butanoic acid Traditional Name: 2-(4,5-dimethyl-2-p-toluoylimino-4-thiazolin-3-yl)butyric acid Formula: C17H20N2O3S MolecularWeight: 332.4173

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C(=O)O)N1C(=C(SC1=NC(=O)C2=CC=C(C=C2)C)C)C

Isomeric SMILES

CCC(C(=O)O)N1C(=C(SC1=NC(=O)C2=CC=C(C=C2)C)C)C

InChI

InChI=1S/C17H20N2O3S/c1-5-14(16(21)22)19-11(3)12(4)23-17(19)18-15(20)13-8-6-10(2)7-9-13/h6-9,14H,5H2,1-4H3,(H,21,22)