2-[(5-azanylquinolin-8-yl)methylsulfanyl]-6-methyl-1H-pyrimidin-4-one

Systemtic Name: 2-[(5-azanylquinolin-8-yl)methylsulfanyl]-6-methyl-1H-pyrimidin-4-one Openeye Name: 2-[(5-amino-8-quinolyl)methylsulfanyl]-6-methyl-1H-pyrimidin-4-one CAS Name: 2-[(5-amino-8-quinolinyl)methylthio]-6-methyl-1H-pyrimidin-4-one IUPAC Name: 2-[(5-aminoquinolin-8-yl)methylsulfanyl]-6-methyl-1H-pyrimidin-4-one Traditional Name: 2-[(5-amino-8-quinolyl)methylthio]-6-methyl-1H-pyrimidin-4-one Formula: C15H14N4OS MolecularWeight: 298.36286

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=O)N=C(N1)SCC2=C3C(=C(C=C2)N)C=CC=N3

Isomeric SMILES

CC1=CC(=O)N=C(N1)SCC2=C3C(=C(C=C2)N)C=CC=N3

InChI

InChI=1S/C15H14N4OS/c1-9-7-13(20)19-15(18-9)21-8-10-4-5-12(16)11-3-2-6-17-14(10)11/h2-7H,8,16H2,1H3,(H,18,19,20)