2-[(6-azanyl-1H-benzimidazol-2-yl)methylsulfanyl]-6-methyl-1H-pyrimidin-4-one

Systemtic Name: 2-[(6-azanyl-1H-benzimidazol-2-yl)methylsulfanyl]-6-methyl-1H-pyrimidin-4-one Openeye Name: 2-[(6-amino-1H-benzimidazol-2-yl)methylsulfanyl]-6-methyl-1H-pyrimidin-4-one CAS Name: 2-[(6-amino-1H-benzimidazol-2-yl)methylthio]-6-methyl-1H-pyrimidin-4-one IUPAC Name: 2-[(6-amino-1H-benzimidazol-2-yl)methylsulfanyl]-6-methyl-1H-pyrimidin-4-one Traditional Name: 2-[(6-amino-1H-benzimidazol-2-yl)methylthio]-6-methyl-1H-pyrimidin-4-one Formula: C13H13N5OS MolecularWeight: 287.34022

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=O)N=C(N1)SCC2=NC3=C(N2)C=C(C=C3)N

Isomeric SMILES

CC1=CC(=O)N=C(N1)SCC2=NC3=C(N2)C=C(C=C3)N

InChI

InChI=1S/C13H13N5OS/c1-7-4-12(19)18-13(15-7)20-6-11-16-9-3-2-8(14)5-10(9)17-11/h2-5H,6,14H2,1H3,(H,16,17)(H,15,18,19)