1-[3-[[2-(2-hydroxyethyl)-5-methoxy-phenyl]amino]quinoxalin-2-yl]propane-1-sulfonamide

Systemtic Name: 1-[3-[[2-(2-hydroxyethyl)-5-methoxy-phenyl]amino]quinoxalin-2-yl]propane-1-sulfonamide Openeye Name: 1-[3-[2-(2-hydroxyethyl)-5-methoxy-anilino]quinoxalin-2-yl]propane-1-sulfonamide CAS Name: 1-[3-[2-(2-hydroxyethyl)-5-methoxyanilino]-2-quinoxalinyl]-1-propanesulfonamide IUPAC Name: 1-[3-[2-(2-hydroxyethyl)-5-methoxyanilino]quinoxalin-2-yl]propane-1-sulfonamide Traditional Name: 1-[3-[2-(2-hydroxyethyl)-5-methoxy-anilino]quinoxalin-2-yl]propane-1-sulfonamide Formula: C20H24N4O4S MolecularWeight: 416.49396

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C1=NC2=CC=CC=C2N=C1NC3=C(C=CC(=C3)OC)CCO)S(=O)(=O)N

Isomeric SMILES

CCC(C1=NC2=CC=CC=C2N=C1NC3=C(C=CC(=C3)OC)CCO)S(=O)(=O)N

InChI

InChI=1S/C20H24N4O4S/c1-3-18(29(21,26)27)19-20(23-16-7-5-4-6-15(16)22-19)24-17-12-14(28-2)9-8-13(17)10-11-25/h4-9,12,18,25H,3,10-11H2,1-2H3,(H,23,24)(H2,21,26,27)