2-[3-(5-azanyl-2-oxidanylidene-pyridin-1-yl)propylsulfanyl]-6-methyl-1H-pyrimidin-4-one

Systemtic Name: 2-[3-(5-azanyl-2-oxidanylidene-pyridin-1-yl)propylsulfanyl]-6-methyl-1H-pyrimidin-4-one Openeye Name: 2-[3-(5-amino-2-oxo-1-pyridyl)propylsulfanyl]-6-methyl-1H-pyrimidin-4-one CAS Name: 2-[3-(5-amino-2-oxo-1-pyridinyl)propylthio]-6-methyl-1H-pyrimidin-4-one IUPAC Name: 2-[3-(5-amino-2-oxopyridin-1-yl)propylsulfanyl]-6-methyl-1H-pyrimidin-4-one Traditional Name: 2-[3-(5-amino-2-keto-1-pyridyl)propylthio]-6-methyl-1H-pyrimidin-4-one Formula: C13H16N4O2S MolecularWeight: 292.35674

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=O)N=C(N1)SCCCN2C=C(C=CC2=O)N

Isomeric SMILES

CC1=CC(=O)N=C(N1)SCCCN2C=C(C=CC2=O)N

InChI

InChI=1S/C13H16N4O2S/c1-9-7-11(18)16-13(15-9)20-6-2-5-17-8-10(14)3-4-12(17)19/h3-4,7-8H,2,5-6,14H2,1H3,(H,15,16,18)