[2-[(4-bromophenyl)amino]-2-oxidanylidene-ethyl] 3-[(2-methyl-1,3-thiazol-4-yl)methoxy]benzoate

Systemtic Name: [2-[(4-bromophenyl)amino]-2-oxidanylidene-ethyl] 3-[(2-methyl-1,3-thiazol-4-yl)methoxy]benzoate Openeye Name: [2-(4-bromoanilino)-2-oxo-ethyl] 3-[(2-methylthiazol-4-yl)methoxy]benzoate CAS Name: 3-[(2-methyl-4-thiazolyl)methoxy]benzoic acid [2-(4-bromoanilino)-2-oxoethyl] ester IUPAC Name: [2-(4-bromoanilino)-2-oxoethyl] 3-[(2-methyl-1,3-thiazol-4-yl)methoxy]benzoate Traditional Name: 3-[(2-methylthiazol-4-yl)methoxy]benzoic acid [2-(4-bromoanilino)-2-keto-ethyl] ester Formula: C20H17BrN2O4S MolecularWeight: 461.32898

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=CS1)COC2=CC=CC(=C2)C(=O)OCC(=O)NC3=CC=C(C=C3)Br

Isomeric SMILES

CC1=NC(=CS1)COC2=CC=CC(=C2)C(=O)OCC(=O)NC3=CC=C(C=C3)Br

InChI

InChI=1S/C20H17BrN2O4S/c1-13-22-17(12-28-13)10-26-18-4-2-3-14(9-18)20(25)27-11-19(24)23-16-7-5-15(21)6-8-16/h2-9,12H,10-11H2,1H3,(H,23,24)