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

Systemtic Name: 2-[(6-methyl-1H-benzimidazol-2-yl)methylsulfanyl]-6-propyl-1H-pyrimidin-4-one Openeye Name: 2-[(6-methyl-1H-benzimidazol-2-yl)methylsulfanyl]-6-propyl-1H-pyrimidin-4-one CAS Name: 2-[(6-methyl-1H-benzimidazol-2-yl)methylthio]-6-propyl-1H-pyrimidin-4-one IUPAC Name: 2-[(6-methyl-1H-benzimidazol-2-yl)methylsulfanyl]-6-propyl-1H-pyrimidin-4-one Traditional Name: 2-[(6-methyl-1H-benzimidazol-2-yl)methylthio]-6-propyl-1H-pyrimidin-4-one Formula: C16H18N4OS MolecularWeight: 314.40532

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=CC(=O)N=C(N1)SCC2=NC3=C(N2)C=C(C=C3)C

Isomeric SMILES

CCCC1=CC(=O)N=C(N1)SCC2=NC3=C(N2)C=C(C=C3)C

InChI

InChI=1S/C16H18N4OS/c1-3-4-11-8-15(21)20-16(17-11)22-9-14-18-12-6-5-10(2)7-13(12)19-14/h5-8H,3-4,9H2,1-2H3,(H,18,19)(H,17,20,21)