[2-(4-methylphenyl)-1,3-thiazol-4-yl]methyl 6-methyl-4-oxidanylidene-chromene-2-carboxylate

Systemtic Name: [2-(4-methylphenyl)-1,3-thiazol-4-yl]methyl 6-methyl-4-oxidanylidene-chromene-2-carboxylate Openeye Name: [2-(p-tolyl)thiazol-4-yl]methyl 6-methyl-4-oxo-chromene-2-carboxylate CAS Name: 6-methyl-4-oxo-1-benzopyran-2-carboxylic acid [2-(4-methylphenyl)-4-thiazolyl]methyl ester IUPAC Name: [2-(4-methylphenyl)-1,3-thiazol-4-yl]methyl 6-methyl-4-oxochromene-2-carboxylate Traditional Name: 4-keto-6-methyl-chromene-2-carboxylic acid [2-(p-tolyl)thiazol-4-yl]methyl ester Formula: C22H17NO4S MolecularWeight: 391.43968

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=NC(=CS2)COC(=O)C3=CC(=O)C4=C(O3)C=CC(=C4)C

Isomeric SMILES

CC1=CC=C(C=C1)C2=NC(=CS2)COC(=O)C3=CC(=O)C4=C(O3)C=CC(=C4)C

InChI

InChI=1S/C22H17NO4S/c1-13-3-6-15(7-4-13)21-23-16(12-28-21)11-26-22(25)20-10-18(24)17-9-14(2)5-8-19(17)27-20/h3-10,12H,11H2,1-2H3