2-(1-isoquinolin-3-ylethylsulfanyl)-6-methylsulfanyl-pyrimidin-4-amine

Systemtic Name: 2-(1-isoquinolin-3-ylethylsulfanyl)-6-methylsulfanyl-pyrimidin-4-amine Openeye Name: 2-[1-(3-isoquinolyl)ethylsulfanyl]-6-methylsulfanyl-pyrimidin-4-amine CAS Name: 2-[1-(3-isoquinolinyl)ethylthio]-6-(methylthio)-4-pyrimidinamine IUPAC Name: 2-(1-isoquinolin-3-ylethylsulfanyl)-6-methylsulfanylpyrimidin-4-amine Traditional Name: [2-[1-(3-isoquinolyl)ethylthio]-6-(methylthio)pyrimidin-4-yl]amine Formula: C16H16N4S2 MolecularWeight: 328.45504

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC2=CC=CC=C2C=N1)SC3=NC(=CC(=N3)SC)N

Isomeric SMILES

CC(C1=CC2=CC=CC=C2C=N1)SC3=NC(=CC(=N3)SC)N

InChI

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