ethyl 4-azanyl-6-[[4-(cyclopropylsulfamoyl)phenyl]carbonylamino]quinoline-3-carboxylate

Systemtic Name: ethyl 4-azanyl-6-[[4-(cyclopropylsulfamoyl)phenyl]carbonylamino]quinoline-3-carboxylate Openeye Name: ethyl 4-amino-6-[[4-(cyclopropylsulfamoyl)benzoyl]amino]quinoline-3-carboxylate CAS Name: 4-amino-6-[[[4-(cyclopropylsulfamoyl)phenyl]-oxomethyl]amino]-3-quinolinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-amino-6-[[4-(cyclopropylsulfamoyl)benzoyl]amino]quinoline-3-carboxylate Traditional Name: 4-amino-6-[[4-(cyclopropylsulfamoyl)benzoyl]amino]quinoline-3-carboxylic acid ethyl ester Formula: C22H22N4O5S MolecularWeight: 454.49888

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CN=C2C=CC(=CC2=C1N)NC(=O)C3=CC=C(C=C3)S(=O)(=O)NC4CC4

Isomeric SMILES

CCOC(=O)C1=CN=C2C=CC(=CC2=C1N)NC(=O)C3=CC=C(C=C3)S(=O)(=O)NC4CC4

InChI

InChI=1S/C22H22N4O5S/c1-2-31-22(28)18-12-24-19-10-7-15(11-17(19)20(18)23)25-21(27)13-3-8-16(9-4-13)32(29,30)26-14-5-6-14/h3-4,7-12,14,26H,2,5-6H2,1H3,(H2,23,24)(H,25,27)