[4-[(Z)-(2-acetamido-4-oxidanylidene-1,3-thiazol-5-ylidene)methyl]phenyl] 4-bromanylbenzoate

Systemtic Name: [4-[(Z)-(2-acetamido-4-oxidanylidene-1,3-thiazol-5-ylidene)methyl]phenyl] 4-bromanylbenzoate Openeye Name: [4-[(Z)-(2-acetamido-4-oxo-thiazol-5-ylidene)methyl]phenyl] 4-bromobenzoate CAS Name: 4-bromobenzoic acid [4-[(Z)-(2-acetamido-4-oxo-5-thiazolylidene)methyl]phenyl] ester IUPAC Name: [4-[(Z)-(2-acetamido-4-oxo-1,3-thiazol-5-ylidene)methyl]phenyl] 4-bromobenzoate Traditional Name: 4-bromobenzoic acid [4-[(Z)-(2-acetamido-4-keto-2-thiazolin-5-ylidene)methyl]phenyl] ester Formula: C19H13BrN2O4S MolecularWeight: 445.28652

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=NC(=O)C(=CC2=CC=C(C=C2)OC(=O)C3=CC=C(C=C3)Br)S1

Isomeric SMILES

CC(=O)NC1=NC(=O)/C(=C/C2=CC=C(C=C2)OC(=O)C3=CC=C(C=C3)Br)/S1

InChI

InChI=1S/C19H13BrN2O4S/c1-11(23)21-19-22-17(24)16(27-19)10-12-2-8-15(9-3-12)26-18(25)13-4-6-14(20)7-5-13/h2-10H,1H3,(H,21,22,23,24)/b16-10-