4-[[(5Z)-4-oxidanylidene-5-[(4-propoxyphenyl)methylidene]-1,3-thiazol-2-yl]amino]benzoic acid

Systemtic Name: 4-[[(5Z)-4-oxidanylidene-5-[(4-propoxyphenyl)methylidene]-1,3-thiazol-2-yl]amino]benzoic acid Openeye Name: 4-[[(5Z)-4-oxo-5-[(4-propoxyphenyl)methylene]thiazol-2-yl]amino]benzoic acid CAS Name: 4-[[(5Z)-4-oxo-5-[(4-propoxyphenyl)methylidene]-2-thiazolyl]amino]benzoic acid IUPAC Name: 4-[[(5Z)-4-oxo-5-[(4-propoxyphenyl)methylidene]-1,3-thiazol-2-yl]amino]benzoic acid Traditional Name: 4-[[(5Z)-4-keto-5-(4-propoxybenzylidene)-2-thiazolin-2-yl]amino]benzoic acid Formula: C20H18N2O4S MolecularWeight: 382.43292

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=CC=C(C=C1)C=C2C(=O)N=C(S2)NC3=CC=C(C=C3)C(=O)O

Isomeric SMILES

CCCOC1=CC=C(C=C1)/C=C\2/C(=O)N=C(S2)NC3=CC=C(C=C3)C(=O)O

InChI

InChI=1S/C20H18N2O4S/c1-2-11-26-16-9-3-13(4-10-16)12-17-18(23)22-20(27-17)21-15-7-5-14(6-8-15)19(24)25/h3-10,12H,2,11H2,1H3,(H,24,25)(H,21,22,23)/b17-12-