4-oxidanylidene-4-[[4-(2-phenylazanyl-1,3-thiazol-4-yl)phenyl]amino]butanoic acid

Systemtic Name: 4-oxidanylidene-4-[[4-(2-phenylazanyl-1,3-thiazol-4-yl)phenyl]amino]butanoic acid Openeye Name: 4-[4-(2-anilinothiazol-4-yl)anilino]-4-oxo-butanoic acid CAS Name: 4-[4-(2-anilino-4-thiazolyl)anilino]-4-oxobutanoic acid IUPAC Name: 4-[4-(2-anilino-1,3-thiazol-4-yl)anilino]-4-oxobutanoic acid Traditional Name: 4-[4-(2-anilinothiazol-4-yl)anilino]-4-keto-butyric acid Formula: C19H17N3O3S MolecularWeight: 367.42158

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)NC2=NC(=CS2)C3=CC=C(C=C3)NC(=O)CCC(=O)O

Isomeric SMILES

C1=CC=C(C=C1)NC2=NC(=CS2)C3=CC=C(C=C3)NC(=O)CCC(=O)O

InChI

InChI=1S/C19H17N3O3S/c23-17(10-11-18(24)25)20-15-8-6-13(7-9-15)16-12-26-19(22-16)21-14-4-2-1-3-5-14/h1-9,12H,10-11H2,(H,20,23)(H,21,22)(H,24,25)