ethyl 2-[(5-bromanylpyridin-3-yl)carbonylamino]-1,3-benzothiazole-6-carboxylate

Systemtic Name: ethyl 2-[(5-bromanylpyridin-3-yl)carbonylamino]-1,3-benzothiazole-6-carboxylate Openeye Name: ethyl 2-[(5-bromopyridine-3-carbonyl)amino]-1,3-benzothiazole-6-carboxylate CAS Name: 2-[[(5-bromo-3-pyridinyl)-oxomethyl]amino]-1,3-benzothiazole-6-carboxylic acid ethyl ester IUPAC Name: ethyl 2-[(5-bromopyridine-3-carbonyl)amino]-1,3-benzothiazole-6-carboxylate Traditional Name: 2-[(5-bromonicotinoyl)amino]-1,3-benzothiazole-6-carboxylic acid ethyl ester Formula: C16H12BrN3O3S MolecularWeight: 406.25378

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC2=C(C=C1)N=C(S2)NC(=O)C3=CC(=CN=C3)Br

Isomeric SMILES

CCOC(=O)C1=CC2=C(C=C1)N=C(S2)NC(=O)C3=CC(=CN=C3)Br

InChI

InChI=1S/C16H12BrN3O3S/c1-2-23-15(22)9-3-4-12-13(6-9)24-16(19-12)20-14(21)10-5-11(17)8-18-7-10/h3-8H,2H2,1H3,(H,19,20,21)