5-[[(E)-2-cyano-2-(4-phenyl-1,3-thiazol-2-yl)ethenyl]amino]-2-oxidanyl-benzoic acid

Systemtic Name: 5-[[(E)-2-cyano-2-(4-phenyl-1,3-thiazol-2-yl)ethenyl]amino]-2-oxidanyl-benzoic acid Openeye Name: 5-[[(E)-2-cyano-2-(4-phenylthiazol-2-yl)vinyl]amino]-2-hydroxy-benzoic acid CAS Name: 5-[[(E)-2-cyano-2-(4-phenyl-2-thiazolyl)ethenyl]amino]-2-hydroxybenzoic acid IUPAC Name: 5-[[(E)-2-cyano-2-(4-phenyl-1,3-thiazol-2-yl)ethenyl]amino]-2-hydroxybenzoic acid Traditional Name: 5-[[(E)-2-cyano-2-(4-phenylthiazol-2-yl)vinyl]amino]-2-hydroxy-benzoic acid Formula: C19H13N3O3S MolecularWeight: 363.38982

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=CSC(=N2)C(=CNC3=CC(=C(C=C3)O)C(=O)O)C#N

Isomeric SMILES

C1=CC=C(C=C1)C2=CSC(=N2)/C(=C/NC3=CC(=C(C=C3)O)C(=O)O)/C#N

InChI

InChI=1S/C19H13N3O3S/c20-9-13(10-21-14-6-7-17(23)15(8-14)19(24)25)18-22-16(11-26-18)12-4-2-1-3-5-12/h1-8,10-11,21,23H,(H,24,25)/b13-10+