2-methyl-4-[3-(2-sulfosulfanylethylamino)propoxy]quinoline

Systemtic Name: 2-methyl-4-[3-(2-sulfosulfanylethylamino)propoxy]quinoline Openeye Name: 2-methyl-4-[3-(2-sulfosulfanylethylamino)propoxy]quinoline CAS Name: 2-methyl-4-[3-[2-(sulfothio)ethylamino]propoxy]quinoline IUPAC Name: 2-methyl-4-[3-(2-sulfosulfanylethylamino)propoxy]quinoline Traditional Name: 2-methyl-4-[3-[2-(sulfothio)ethylamino]propoxy]quinoline Formula: C15H20N2O4S2 MolecularWeight: 356.4603

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=NC2=CC=CC=C2C(=C1)OCCCNCCSS(=O)(=O)O

Isomeric SMILES

CC1=NC2=CC=CC=C2C(=C1)OCCCNCCSS(=O)(=O)O

InChI

InChI=1S/C15H20N2O4S2/c1-12-11-15(13-5-2-3-6-14(13)17-12)21-9-4-7-16-8-10-22-23(18,19)20/h2-3,5-6,11,16H,4,7-10H2,1H3,(H,18,19,20)