propan-2-yl 2-bromanyl-4-methyl-3-([1,2,4]triazolo[1,5-a]pyrimidin-2-ylsulfonylamino)benzoate

Systemtic Name: propan-2-yl 2-bromanyl-4-methyl-3-([1,2,4]triazolo[1,5-a]pyrimidin-2-ylsulfonylamino)benzoate Openeye Name: isopropyl 2-bromo-4-methyl-3-([1,2,4]triazolo[1,5-a]pyrimidin-2-ylsulfonylamino)benzoate CAS Name: 2-bromo-4-methyl-3-([1,2,4]triazolo[1,5-a]pyrimidin-2-ylsulfonylamino)benzoic acid propan-2-yl ester IUPAC Name: propan-2-yl 2-bromo-4-methyl-3-([1,2,4]triazolo[1,5-a]pyrimidin-2-ylsulfonylamino)benzoate Traditional Name: 2-bromo-4-methyl-3-([1,2,4]triazolo[1,5-a]pyrimidin-2-ylsulfonylamino)benzoic acid isopropyl ester Formula: C16H16BrN5O4S MolecularWeight: 454.29834

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=C(C=C1)C(=O)OC(C)C)Br)NS(=O)(=O)C2=NN3C=CC=NC3=N2

Isomeric SMILES

CC1=C(C(=C(C=C1)C(=O)OC(C)C)Br)NS(=O)(=O)C2=NN3C=CC=NC3=N2

InChI

InChI=1S/C16H16BrN5O4S/c1-9(2)26-14(23)11-6-5-10(3)13(12(11)17)21-27(24,25)16-19-15-18-7-4-8-22(15)20-16/h4-9,21H,1-3H3