2-[3-(methylamino)-2-oxidanyl-propyl]sulfanyl-6-propyl-1H-pyrimidin-4-one

Systemtic Name: 2-[3-(methylamino)-2-oxidanyl-propyl]sulfanyl-6-propyl-1H-pyrimidin-4-one Openeye Name: 2-[2-hydroxy-3-(methylamino)propyl]sulfanyl-6-propyl-1H-pyrimidin-4-one CAS Name: 2-[[2-hydroxy-3-(methylamino)propyl]thio]-6-propyl-1H-pyrimidin-4-one IUPAC Name: 2-[2-hydroxy-3-(methylamino)propyl]sulfanyl-6-propyl-1H-pyrimidin-4-one Traditional Name: 2-[[2-hydroxy-3-(methylamino)propyl]thio]-6-propyl-1H-pyrimidin-4-one Formula: C11H19N3O2S MolecularWeight: 257.35246

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=CC(=O)N=C(N1)SCC(CNC)O

Isomeric SMILES

CCCC1=CC(=O)N=C(N1)SCC(CNC)O

InChI

InChI=1S/C11H19N3O2S/c1-3-4-8-5-10(16)14-11(13-8)17-7-9(15)6-12-2/h5,9,12,15H,3-4,6-7H2,1-2H3,(H,13,14,16)