3-[[4-azanyl-2-(2-quinolin-5-ylethoxy)phenyl]sulfonylamino]-4-(methylamino)-4-oxidanylidene-butanoic acid

Systemtic Name: 3-[[4-azanyl-2-(2-quinolin-5-ylethoxy)phenyl]sulfonylamino]-4-(methylamino)-4-oxidanylidene-butanoic acid Openeye Name: 3-[[4-amino-2-[2-(5-quinolyl)ethoxy]phenyl]sulfonylamino]-4-(methylamino)-4-oxo-butanoic acid CAS Name: 3-[[4-amino-2-[2-(5-quinolinyl)ethoxy]phenyl]sulfonylamino]-4-(methylamino)-4-oxobutanoic acid IUPAC Name: 3-[[4-amino-2-(2-quinolin-5-ylethoxy)phenyl]sulfonylamino]-4-(methylamino)-4-oxobutanoic acid Traditional Name: 3-[[4-amino-2-[2-(5-quinolyl)ethoxy]phenyl]sulfonylamino]-4-keto-4-(methylamino)butyric acid Formula: C22H24N4O6S MolecularWeight: 472.51416

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Descriptors Computed from Structure

Canonical SMILES:

CNC(=O)C(CC(=O)O)NS(=O)(=O)C1=C(C=C(C=C1)N)OCCC2=C3C=CC=NC3=CC=C2

Isomeric SMILES

CNC(=O)C(CC(=O)O)NS(=O)(=O)C1=C(C=C(C=C1)N)OCCC2=C3C=CC=NC3=CC=C2

InChI

InChI=1S/C22H24N4O6S/c1-24-22(29)18(13-21(27)28)26-33(30,31)20-8-7-15(23)12-19(20)32-11-9-14-4-2-6-17-16(14)5-3-10-25-17/h2-8,10,12,18,26H,9,11,13,23H2,1H3,(H,24,29)(H,27,28)