4-(2-oxidanylidene-4-phenyl-1,3-thiazol-3-yl)butanoate

Systemtic Name: 4-(2-oxidanylidene-4-phenyl-1,3-thiazol-3-yl)butanoate Openeye Name: 4-(2-oxo-4-phenyl-thiazol-3-yl)butanoate CAS Name: 4-(2-oxo-4-phenyl-3-thiazolyl)butanoate IUPAC Name: 4-(2-oxo-4-phenyl-1,3-thiazol-3-yl)butanoate Traditional Name: 4-(2-keto-4-phenyl-4-thiazolin-3-yl)butyrate Formula: C13H12NO3S- MolecularWeight: 262.30428

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=CSC(=O)N2CCCC(=O)[O-]

Isomeric SMILES

C1=CC=C(C=C1)C2=CSC(=O)N2CCCC(=O)[O-]

InChI

InChI=1S/C13H13NO3S/c15-12(16)7-4-8-14-11(9-18-13(14)17)10-5-2-1-3-6-10/h1-3,5-6,9H,4,7-8H2,(H,15,16)/p-1