N-[(2-azanylquinolin-3-yl)methyl]-N-(2,2-dimethoxyethyl)-4-methyl-benzenesulfonamide

Systemtic Name: N-[(2-azanylquinolin-3-yl)methyl]-N-(2,2-dimethoxyethyl)-4-methyl-benzenesulfonamide Openeye Name: N-[(2-amino-3-quinolyl)methyl]-N-(2,2-dimethoxyethyl)-4-methyl-benzenesulfonamide CAS Name: N-[(2-amino-3-quinolinyl)methyl]-N-(2,2-dimethoxyethyl)-4-methylbenzenesulfonamide IUPAC Name: N-[(2-aminoquinolin-3-yl)methyl]-N-(2,2-dimethoxyethyl)-4-methylbenzenesulfonamide Traditional Name: N-[(2-amino-3-quinolyl)methyl]-N-(2,2-dimethoxyethyl)-4-methyl-benzenesulfonamide Formula: C21H25N3O4S MolecularWeight: 415.5059

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)N(CC2=CC3=CC=CC=C3N=C2N)CC(OC)OC

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N(CC2=CC3=CC=CC=C3N=C2N)CC(OC)OC

InChI

InChI=1S/C21H25N3O4S/c1-15-8-10-18(11-9-15)29(25,26)24(14-20(27-2)28-3)13-17-12-16-6-4-5-7-19(16)23-21(17)22/h4-12,20H,13-14H2,1-3H3,(H2,22,23)