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5-methoxy-6-methyl-2-methylsulfanyl-1H-pyrimidin-4-one hydrate

5-methoxy-6-methyl-2-methylsulfanyl-1H-pyrimidin-4-one hydrate

Systemtic Name:5-methoxy-6-methyl-2-methylsulfanyl-1H-pyrimidin-4-one hydrate
Openeye Name:5-methoxy-6-methyl-2-methylsulfanyl-1H-pyrimidin-4-one hydrate
CAS Name:5-methoxy-6-methyl-2-(methylthio)-1H-pyrimidin-4-one hydrate
IUPAC Name:5-methoxy-6-methyl-2-methylsulfanyl-1H-pyrimidin-4-one hydrate
Traditional Name:5-methoxy-6-methyl-2-(methylthio)-1H-pyrimidin-4-one hydrate
Formula: C7H12N2O3S
MolecularWeight: 204.24678
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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)N=C(N1)SC)OC.O


Isomeric SMILES

CC1=C(C(=O)N=C(N1)SC)OC.O


InChI

InChI=1S/C7H10N2O2S.H2O/c1-4-5(11-2)6(10)9-7(8-4)12-3;/h1-3H3,(H,8,9,10);1H2


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