ethyl 3-bromanyl-4-[2-[(3-cyanopyridin-2-yl)amino]ethylsulfamoyl]benzoate

Systemtic Name: ethyl 3-bromanyl-4-[2-[(3-cyanopyridin-2-yl)amino]ethylsulfamoyl]benzoate Openeye Name: ethyl 3-bromo-4-[2-[(3-cyano-2-pyridyl)amino]ethylsulfamoyl]benzoate CAS Name: 3-bromo-4-[2-[(3-cyano-2-pyridinyl)amino]ethylsulfamoyl]benzoic acid ethyl ester IUPAC Name: ethyl 3-bromo-4-[2-[(3-cyanopyridin-2-yl)amino]ethylsulfamoyl]benzoate Traditional Name: 3-bromo-4-[2-[(3-cyano-2-pyridyl)amino]ethylsulfamoyl]benzoic acid ethyl ester Formula: C17H17BrN4O4S MolecularWeight: 453.31028

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC(=C(C=C1)S(=O)(=O)NCCNC2=C(C=CC=N2)C#N)Br

Isomeric SMILES

CCOC(=O)C1=CC(=C(C=C1)S(=O)(=O)NCCNC2=C(C=CC=N2)C#N)Br

InChI

InChI=1S/C17H17BrN4O4S/c1-2-26-17(23)12-5-6-15(14(18)10-12)27(24,25)22-9-8-21-16-13(11-19)4-3-7-20-16/h3-7,10,22H,2,8-9H2,1H3,(H,20,21)