5-bromanyl-6-methylsulfanyl-2-[1-(5,6,7,8-tetrahydroisoquinolin-1-yl)ethylsulfanyl]pyrimidin-4-amine

Systemtic Name: 5-bromanyl-6-methylsulfanyl-2-[1-(5,6,7,8-tetrahydroisoquinolin-1-yl)ethylsulfanyl]pyrimidin-4-amine Openeye Name: 5-bromo-6-methylsulfanyl-2-[1-(5,6,7,8-tetrahydroisoquinolin-1-yl)ethylsulfanyl]pyrimidin-4-amine CAS Name: 5-bromo-6-(methylthio)-2-[1-(5,6,7,8-tetrahydroisoquinolin-1-yl)ethylthio]-4-pyrimidinamine IUPAC Name: 5-bromo-6-methylsulfanyl-2-[1-(5,6,7,8-tetrahydroisoquinolin-1-yl)ethylsulfanyl]pyrimidin-4-amine Traditional Name: [5-bromo-6-(methylthio)-2-[1-(5,6,7,8-tetrahydroisoquinolin-1-yl)ethylthio]pyrimidin-4-yl]amine Formula: C16H19BrN4S2 MolecularWeight: 411.38286

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C1=NC=CC2=C1CCCC2)SC3=NC(=C(C(=N3)SC)Br)N

Isomeric SMILES

CC(C1=NC=CC2=C1CCCC2)SC3=NC(=C(C(=N3)SC)Br)N

InChI

InChI=1S/C16H19BrN4S2/c1-9(13-11-6-4-3-5-10(11)7-8-19-13)23-16-20-14(18)12(17)15(21-16)22-2/h7-9H,3-6H2,1-2H3,(H2,18,20,21)