[2-[2-[(4-methylphenyl)amino]-2-oxidanylidene-ethyl]-1,3-thiazol-4-yl]methyl 2-ethoxybenzoate

Systemtic Name: [2-[2-[(4-methylphenyl)amino]-2-oxidanylidene-ethyl]-1,3-thiazol-4-yl]methyl 2-ethoxybenzoate Openeye Name: [2-[2-(4-methylanilino)-2-oxo-ethyl]thiazol-4-yl]methyl 2-ethoxybenzoate CAS Name: 2-ethoxybenzoic acid [2-[2-(4-methylanilino)-2-oxoethyl]-4-thiazolyl]methyl ester IUPAC Name: [2-[2-(4-methylanilino)-2-oxoethyl]-1,3-thiazol-4-yl]methyl 2-ethoxybenzoate Traditional Name: 2-ethoxybenzoic acid [2-[2-keto-2-(p-toluidino)ethyl]thiazol-4-yl]methyl ester Formula: C22H22N2O4S MolecularWeight: 410.48608

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=CC=C1C(=O)OCC2=CSC(=N2)CC(=O)NC3=CC=C(C=C3)C

Isomeric SMILES

CCOC1=CC=CC=C1C(=O)OCC2=CSC(=N2)CC(=O)NC3=CC=C(C=C3)C

InChI

InChI=1S/C22H22N2O4S/c1-3-27-19-7-5-4-6-18(19)22(26)28-13-17-14-29-21(24-17)12-20(25)23-16-10-8-15(2)9-11-16/h4-11,14H,3,12-13H2,1-2H3,(H,23,25)