methyl 2-cyano-2-[3-[(4-sulfamoylphenyl)methylamino]quinoxalin-2-yl]ethanoate

Systemtic Name: methyl 2-cyano-2-[3-[(4-sulfamoylphenyl)methylamino]quinoxalin-2-yl]ethanoate Openeye Name: methyl 2-cyano-2-[3-[(4-sulfamoylphenyl)methylamino]quinoxalin-2-yl]acetate CAS Name: 2-cyano-2-[3-[(4-sulfamoylphenyl)methylamino]-2-quinoxalinyl]acetic acid methyl ester IUPAC Name: methyl 2-cyano-2-[3-[(4-sulfamoylphenyl)methylamino]quinoxalin-2-yl]acetate Traditional Name: 2-cyano-2-[3-[(4-sulfamoylbenzyl)amino]quinoxalin-2-yl]acetic acid methyl ester Formula: C19H17N5O4S MolecularWeight: 411.43438

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C(C#N)C1=NC2=CC=CC=C2N=C1NCC3=CC=C(C=C3)S(=O)(=O)N

Isomeric SMILES

COC(=O)C(C#N)C1=NC2=CC=CC=C2N=C1NCC3=CC=C(C=C3)S(=O)(=O)N

InChI

InChI=1S/C19H17N5O4S/c1-28-19(25)14(10-20)17-18(24-16-5-3-2-4-15(16)23-17)22-11-12-6-8-13(9-7-12)29(21,26)27/h2-9,14H,11H2,1H3,(H,22,24)(H2,21,26,27)