butyl 2-azanyl-1-(4-sulfamoylphenyl)pyrrolo[3,2-b]quinoxaline-3-carboxylate

Systemtic Name: butyl 2-azanyl-1-(4-sulfamoylphenyl)pyrrolo[3,2-b]quinoxaline-3-carboxylate Openeye Name: butyl 2-amino-1-(4-sulfamoylphenyl)pyrrolo[3,2-b]quinoxaline-3-carboxylate CAS Name: 2-amino-1-(4-sulfamoylphenyl)-3-pyrrolo[3,2-b]quinoxalinecarboxylic acid butyl ester IUPAC Name: butyl 2-amino-1-(4-sulfamoylphenyl)pyrrolo[3,2-b]quinoxaline-3-carboxylate Traditional Name: 2-amino-1-(4-sulfamoylphenyl)pyrrolo[3,2-b]quinoxaline-3-carboxylic acid butyl ester Formula: C21H21N5O4S MolecularWeight: 439.48754

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC(=O)C1=C(N(C2=NC3=CC=CC=C3N=C12)C4=CC=C(C=C4)S(=O)(=O)N)N

Isomeric SMILES

CCCCOC(=O)C1=C(N(C2=NC3=CC=CC=C3N=C12)C4=CC=C(C=C4)S(=O)(=O)N)N

InChI

InChI=1S/C21H21N5O4S/c1-2-3-12-30-21(27)17-18-20(25-16-7-5-4-6-15(16)24-18)26(19(17)22)13-8-10-14(11-9-13)31(23,28)29/h4-11H,2-3,12,22H2,1H3,(H2,23,28,29)