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

Systemtic Name: propan-2-yl 2-[(5-bromanylpyridin-3-yl)carbonylamino]-1,3-benzothiazole-6-carboxylate Openeye Name: isopropyl 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 propan-2-yl ester IUPAC Name: propan-2-yl 2-[(5-bromopyridine-3-carbonyl)amino]-1,3-benzothiazole-6-carboxylate Traditional Name: 2-[(5-bromonicotinoyl)amino]-1,3-benzothiazole-6-carboxylic acid isopropyl ester Formula: C17H14BrN3O3S MolecularWeight: 420.28036

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H14BrN3O3S/c1-9(2)24-16(23)10-3-4-13-14(6-10)25-17(20-13)21-15(22)11-5-12(18)8-19-7-11/h3-9H,1-2H3,(H,20,21,22)