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

Systemtic Name: 4-methyl-2-[[(5Z)-4-oxidanylidene-5-[(2-propoxyphenyl)methylidene]-1,3-thiazol-2-yl]amino]benzoic acid Openeye Name: 4-methyl-2-[[(5Z)-4-oxo-5-[(2-propoxyphenyl)methylene]thiazol-2-yl]amino]benzoic acid CAS Name: 4-methyl-2-[[(5Z)-4-oxo-5-[(2-propoxyphenyl)methylidene]-2-thiazolyl]amino]benzoic acid IUPAC Name: 4-methyl-2-[[(5Z)-4-oxo-5-[(2-propoxyphenyl)methylidene]-1,3-thiazol-2-yl]amino]benzoic acid Traditional Name: 2-[[(5Z)-4-keto-5-(2-propoxybenzylidene)-2-thiazolin-2-yl]amino]-4-methyl-benzoic acid Formula: C21H20N2O4S MolecularWeight: 396.4595

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=CC=CC=C1C=C2C(=O)N=C(S2)NC3=C(C=CC(=C3)C)C(=O)O

Isomeric SMILES

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

InChI

InChI=1S/C21H20N2O4S/c1-3-10-27-17-7-5-4-6-14(17)12-18-19(24)23-21(28-18)22-16-11-13(2)8-9-15(16)20(25)26/h4-9,11-12H,3,10H2,1-2H3,(H,25,26)(H,22,23,24)/b18-12-