2-[(2-chloranylquinolin-3-yl)methylsulfanyl]pyrimidine-4,6-diamine

Systemtic Name: 2-[(2-chloranylquinolin-3-yl)methylsulfanyl]pyrimidine-4,6-diamine Openeye Name: 2-[(2-chloro-3-quinolyl)methylsulfanyl]pyrimidine-4,6-diamine CAS Name: 2-[(2-chloro-3-quinolinyl)methylthio]pyrimidine-4,6-diamine IUPAC Name: 2-[(2-chloroquinolin-3-yl)methylsulfanyl]pyrimidine-4,6-diamine Traditional Name: [6-amino-2-[(2-chloro-3-quinolyl)methylthio]pyrimidin-4-yl]amine Formula: C14H12ClN5S MolecularWeight: 317.79658

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C=C(C(=N2)Cl)CSC3=NC(=CC(=N3)N)N

Isomeric SMILES

C1=CC=C2C(=C1)C=C(C(=N2)Cl)CSC3=NC(=CC(=N3)N)N

InChI

InChI=1S/C14H12ClN5S/c15-13-9(5-8-3-1-2-4-10(8)18-13)7-21-14-19-11(16)6-12(17)20-14/h1-6H,7H2,(H4,16,17,19,20)