[2-[(4-methylphenyl)amino]-1,3-thiazol-4-yl]methyl 3-chloranyl-5-ethoxy-4-oxidanyl-benzoate

Systemtic Name: [2-[(4-methylphenyl)amino]-1,3-thiazol-4-yl]methyl 3-chloranyl-5-ethoxy-4-oxidanyl-benzoate Openeye Name: [2-(4-methylanilino)thiazol-4-yl]methyl 3-chloro-5-ethoxy-4-hydroxy-benzoate CAS Name: 3-chloro-5-ethoxy-4-hydroxybenzoic acid [2-(4-methylanilino)-4-thiazolyl]methyl ester IUPAC Name: [2-(4-methylanilino)-1,3-thiazol-4-yl]methyl 3-chloro-5-ethoxy-4-hydroxybenzoate Traditional Name: 3-chloro-5-ethoxy-4-hydroxy-benzoic acid [2-(p-toluidino)thiazol-4-yl]methyl ester Formula: C20H19ClN2O4S MolecularWeight: 418.89386

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C(=CC(=C1)C(=O)OCC2=CSC(=N2)NC3=CC=C(C=C3)C)Cl)O

Isomeric SMILES

CCOC1=C(C(=CC(=C1)C(=O)OCC2=CSC(=N2)NC3=CC=C(C=C3)C)Cl)O

InChI

InChI=1S/C20H19ClN2O4S/c1-3-26-17-9-13(8-16(21)18(17)24)19(25)27-10-15-11-28-20(23-15)22-14-6-4-12(2)5-7-14/h4-9,11,24H,3,10H2,1-2H3,(H,22,23)