ethyl 3-bromanyl-4-[[2-(dimethylamino)pyridin-3-yl]methylsulfamoyl]benzoate

Systemtic Name: ethyl 3-bromanyl-4-[[2-(dimethylamino)pyridin-3-yl]methylsulfamoyl]benzoate Openeye Name: ethyl 3-bromo-4-[[2-(dimethylamino)-3-pyridyl]methylsulfamoyl]benzoate CAS Name: 3-bromo-4-[[2-(dimethylamino)-3-pyridinyl]methylsulfamoyl]benzoic acid ethyl ester IUPAC Name: ethyl 3-bromo-4-[[2-(dimethylamino)pyridin-3-yl]methylsulfamoyl]benzoate Traditional Name: 3-bromo-4-[[2-(dimethylamino)-3-pyridyl]methylsulfamoyl]benzoic acid ethyl ester Formula: C17H20BrN3O4S MolecularWeight: 442.3274

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC(=C(C=C1)S(=O)(=O)NCC2=C(N=CC=C2)N(C)C)Br

Isomeric SMILES

CCOC(=O)C1=CC(=C(C=C1)S(=O)(=O)NCC2=C(N=CC=C2)N(C)C)Br

InChI

InChI=1S/C17H20BrN3O4S/c1-4-25-17(22)12-7-8-15(14(18)10-12)26(23,24)20-11-13-6-5-9-19-16(13)21(2)3/h5-10,20H,4,11H2,1-3H3