5-bromanyl-6-chloranyl-2-(1-isoquinolin-3-ylethylsulfanyl)pyrimidin-4-amine

Systemtic Name: 5-bromanyl-6-chloranyl-2-(1-isoquinolin-3-ylethylsulfanyl)pyrimidin-4-amine Openeye Name: 5-bromo-6-chloro-2-[1-(3-isoquinolyl)ethylsulfanyl]pyrimidin-4-amine CAS Name: 5-bromo-6-chloro-2-[1-(3-isoquinolinyl)ethylthio]-4-pyrimidinamine IUPAC Name: 5-bromo-6-chloro-2-(1-isoquinolin-3-ylethylsulfanyl)pyrimidin-4-amine Traditional Name: [5-bromo-6-chloro-2-[1-(3-isoquinolyl)ethylthio]pyrimidin-4-yl]amine Formula: C15H12BrClN4S MolecularWeight: 395.70458

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC2=CC=CC=C2C=N1)SC3=NC(=C(C(=N3)Cl)Br)N

Isomeric SMILES

CC(C1=CC2=CC=CC=C2C=N1)SC3=NC(=C(C(=N3)Cl)Br)N

InChI

InChI=1S/C15H12BrClN4S/c1-8(22-15-20-13(17)12(16)14(18)21-15)11-6-9-4-2-3-5-10(9)7-19-11/h2-8H,1H3,(H2,18,20,21)