[2-[ethanoyl(phenyl)amino]-1,3-thiazol-4-yl]methyl 5-bromanyl-2-oxidanyl-benzoate

Systemtic Name: [2-[ethanoyl(phenyl)amino]-1,3-thiazol-4-yl]methyl 5-bromanyl-2-oxidanyl-benzoate Openeye Name: [2-(N-acetylanilino)thiazol-4-yl]methyl 5-bromo-2-hydroxy-benzoate CAS Name: 5-bromo-2-hydroxybenzoic acid [2-(N-acetylanilino)-4-thiazolyl]methyl ester IUPAC Name: [2-(N-acetylanilino)-1,3-thiazol-4-yl]methyl 5-bromo-2-hydroxybenzoate Traditional Name: 5-bromo-2-hydroxy-benzoic acid [2-(N-acetylanilino)thiazol-4-yl]methyl ester Formula: C19H15BrN2O4S MolecularWeight: 447.3024

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)N(C1=CC=CC=C1)C2=NC(=CS2)COC(=O)C3=C(C=CC(=C3)Br)O

Isomeric SMILES

CC(=O)N(C1=CC=CC=C1)C2=NC(=CS2)COC(=O)C3=C(C=CC(=C3)Br)O

InChI

InChI=1S/C19H15BrN2O4S/c1-12(23)22(15-5-3-2-4-6-15)19-21-14(11-27-19)10-26-18(25)16-9-13(20)7-8-17(16)24/h2-9,11,24H,10H2,1H3