2-(3-azanyl-2-oxidanyl-propyl)sulfanyl-6-methyl-1H-pyrimidin-4-one

Systemtic Name: 2-(3-azanyl-2-oxidanyl-propyl)sulfanyl-6-methyl-1H-pyrimidin-4-one Openeye Name: 2-(3-amino-2-hydroxy-propyl)sulfanyl-6-methyl-1H-pyrimidin-4-one CAS Name: 2-[(3-amino-2-hydroxypropyl)thio]-6-methyl-1H-pyrimidin-4-one IUPAC Name: 2-(3-amino-2-hydroxypropyl)sulfanyl-6-methyl-1H-pyrimidin-4-one Traditional Name: 2-[(3-amino-2-hydroxy-propyl)thio]-6-methyl-1H-pyrimidin-4-one Formula: C8H13N3O2S MolecularWeight: 215.27272

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=O)N=C(N1)SCC(CN)O

Isomeric SMILES

CC1=CC(=O)N=C(N1)SCC(CN)O

InChI

InChI=1S/C8H13N3O2S/c1-5-2-7(13)11-8(10-5)14-4-6(12)3-9/h2,6,12H,3-4,9H2,1H3,(H,10,11,13)