[2-[(4-methylphenyl)amino]-1,3-thiazol-4-yl]methyl 5-methoxy-3-methyl-1-benzofuran-2-carboxylate

Systemtic Name: [2-[(4-methylphenyl)amino]-1,3-thiazol-4-yl]methyl 5-methoxy-3-methyl-1-benzofuran-2-carboxylate Openeye Name: [2-(4-methylanilino)thiazol-4-yl]methyl 5-methoxy-3-methyl-benzofuran-2-carboxylate CAS Name: 5-methoxy-3-methyl-2-benzofurancarboxylic acid [2-(4-methylanilino)-4-thiazolyl]methyl ester IUPAC Name: [2-(4-methylanilino)-1,3-thiazol-4-yl]methyl 5-methoxy-3-methyl-1-benzofuran-2-carboxylate Traditional Name: 5-methoxy-3-methyl-coumarilic acid [2-(p-toluidino)thiazol-4-yl]methyl ester Formula: C22H20N2O4S MolecularWeight: 408.4702

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)NC2=NC(=CS2)COC(=O)C3=C(C4=C(O3)C=CC(=C4)OC)C

Isomeric SMILES

CC1=CC=C(C=C1)NC2=NC(=CS2)COC(=O)C3=C(C4=C(O3)C=CC(=C4)OC)C

InChI

InChI=1S/C22H20N2O4S/c1-13-4-6-15(7-5-13)23-22-24-16(12-29-22)11-27-21(25)20-14(2)18-10-17(26-3)8-9-19(18)28-20/h4-10,12H,11H2,1-3H3,(H,23,24)