ethyl 2-(1,3-benzothiazol-2-yl)-3-[(3-bromophenyl)amino]-5-oxidanylidene-1,2-oxazole-4-carboxylate

Systemtic Name: ethyl 2-(1,3-benzothiazol-2-yl)-3-[(3-bromophenyl)amino]-5-oxidanylidene-1,2-oxazole-4-carboxylate Openeye Name: ethyl 2-(1,3-benzothiazol-2-yl)-3-(3-bromoanilino)-5-oxo-isoxazole-4-carboxylate CAS Name: 2-(1,3-benzothiazol-2-yl)-3-(3-bromoanilino)-5-oxo-4-isoxazolecarboxylic acid ethyl ester IUPAC Name: ethyl 2-(1,3-benzothiazol-2-yl)-3-(3-bromoanilino)-5-oxo-1,2-oxazole-4-carboxylate Traditional Name: 2-(1,3-benzothiazol-2-yl)-3-(3-bromoanilino)-5-keto-3-isoxazoline-4-carboxylic acid ethyl ester Formula: C19H14BrN3O4S MolecularWeight: 460.30116

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(N(OC1=O)C2=NC3=CC=CC=C3S2)NC4=CC(=CC=C4)Br

Isomeric SMILES

CCOC(=O)C1=C(N(OC1=O)C2=NC3=CC=CC=C3S2)NC4=CC(=CC=C4)Br

InChI

InChI=1S/C19H14BrN3O4S/c1-2-26-17(24)15-16(21-12-7-5-6-11(20)10-12)23(27-18(15)25)19-22-13-8-3-4-9-14(13)28-19/h3-10,21H,2H2,1H3