2-(1-isoquinolin-1-ylethylsulfanyl)-6-methylsulfanyl-pyrimidin-4-amine

Systemtic Name: 2-(1-isoquinolin-1-ylethylsulfanyl)-6-methylsulfanyl-pyrimidin-4-amine Openeye Name: 2-[1-(1-isoquinolyl)ethylsulfanyl]-6-methylsulfanyl-pyrimidin-4-amine CAS Name: 2-[1-(1-isoquinolinyl)ethylthio]-6-(methylthio)-4-pyrimidinamine IUPAC Name: 2-(1-isoquinolin-1-ylethylsulfanyl)-6-methylsulfanylpyrimidin-4-amine Traditional Name: [2-[1-(1-isoquinolyl)ethylthio]-6-(methylthio)pyrimidin-4-yl]amine Formula: C16H16N4S2 MolecularWeight: 328.45504

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C1=NC=CC2=CC=CC=C21)SC3=NC(=CC(=N3)SC)N

Isomeric SMILES

CC(C1=NC=CC2=CC=CC=C21)SC3=NC(=CC(=N3)SC)N

InChI

InChI=1S/C16H16N4S2/c1-10(22-16-19-13(17)9-14(20-16)21-2)15-12-6-4-3-5-11(12)7-8-18-15/h3-10H,1-2H3,(H2,17,19,20)