(8-bromanyl-2-methyl-3-propyl-quinolin-4-yl)sulfanylmethanediamine

Systemtic Name: (8-bromanyl-2-methyl-3-propyl-quinolin-4-yl)sulfanylmethanediamine Openeye Name: (8-bromo-2-methyl-3-propyl-4-quinolyl)sulfanylmethanediamine CAS Name: [(8-bromo-2-methyl-3-propyl-4-quinolinyl)thio]methanediamine IUPAC Name: (8-bromo-2-methyl-3-propylquinolin-4-yl)sulfanylmethanediamine Traditional Name: [amino-[(8-bromo-2-methyl-3-propyl-4-quinolyl)thio]methyl]amine Formula: C14H18BrN3S MolecularWeight: 340.28182

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCC1=C(C2=C(C(=CC=C2)Br)N=C1C)SC(N)N

Isomeric SMILES

CCCC1=C(C2=C(C(=CC=C2)Br)N=C1C)SC(N)N

InChI

InChI=1S/C14H18BrN3S/c1-3-5-9-8(2)18-12-10(6-4-7-11(12)15)13(9)19-14(16)17/h4,6-7,14H,3,5,16-17H2,1-2H3