N-(furan-2-ylmethyl)-4-oxidanylidene-6-[(2-oxidanylideneazepan-3-yl)sulfamoyl]-1H-quinoline-3-carboxamide

Systemtic Name: N-(furan-2-ylmethyl)-4-oxidanylidene-6-[(2-oxidanylideneazepan-3-yl)sulfamoyl]-1H-quinoline-3-carboxamide Openeye Name: N-(2-furylmethyl)-4-oxo-6-[(2-oxoazepan-3-yl)sulfamoyl]-1H-quinoline-3-carboxamide CAS Name: N-(2-furanylmethyl)-4-oxo-6-[(2-oxo-3-azepanyl)sulfamoyl]-1H-quinoline-3-carboxamide IUPAC Name: N-(furan-2-ylmethyl)-4-oxo-6-[(2-oxoazepan-3-yl)sulfamoyl]-1H-quinoline-3-carboxamide Traditional Name: N-(2-furfuryl)-4-keto-6-[(2-ketoazepan-3-yl)sulfamoyl]-1H-quinoline-3-carboxamide Formula: C21H22N4O6S MolecularWeight: 458.48758

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Descriptors Computed from Structure

Canonical SMILES:

C1CCNC(=O)C(C1)NS(=O)(=O)C2=CC3=C(C=C2)NC=C(C3=O)C(=O)NCC4=CC=CO4

Isomeric SMILES

C1CCNC(=O)C(C1)NS(=O)(=O)C2=CC3=C(C=C2)NC=C(C3=O)C(=O)NCC4=CC=CO4

InChI

InChI=1S/C21H22N4O6S/c26-19-15-10-14(32(29,30)25-18-5-1-2-8-22-21(18)28)6-7-17(15)23-12-16(19)20(27)24-11-13-4-3-9-31-13/h3-4,6-7,9-10,12,18,25H,1-2,5,8,11H2,(H,22,28)(H,23,26)(H,24,27)