N-[4-[3-[2-(6-azanylquinolin-2-yl)ethylamino]-2-oxidanyl-propoxy]phenyl]methanesulfonamide

Systemtic Name: N-[4-[3-[2-(6-azanylquinolin-2-yl)ethylamino]-2-oxidanyl-propoxy]phenyl]methanesulfonamide Openeye Name: N-[4-[3-[2-(6-amino-2-quinolyl)ethylamino]-2-hydroxy-propoxy]phenyl]methanesulfonamide CAS Name: N-[4-[3-[2-(6-amino-2-quinolinyl)ethylamino]-2-hydroxypropoxy]phenyl]methanesulfonamide IUPAC Name: N-[4-[3-[2-(6-aminoquinolin-2-yl)ethylamino]-2-hydroxypropoxy]phenyl]methanesulfonamide Traditional Name: N-[4-[3-[2-(6-amino-2-quinolyl)ethylamino]-2-hydroxy-propoxy]phenyl]methanesulfonamide Formula: C21H26N4O4S MolecularWeight: 430.52054

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)NC1=CC=C(C=C1)OCC(CNCCC2=NC3=C(C=C2)C=C(C=C3)N)O

Isomeric SMILES

CS(=O)(=O)NC1=CC=C(C=C1)OCC(CNCCC2=NC3=C(C=C2)C=C(C=C3)N)O

InChI

InChI=1S/C21H26N4O4S/c1-30(27,28)25-18-5-7-20(8-6-18)29-14-19(26)13-23-11-10-17-4-2-15-12-16(22)3-9-21(15)24-17/h2-9,12,19,23,25-26H,10-11,13-14,22H2,1H3