6-(diethoxymethyl)-2-(phenylmethylsulfanyl)-1H-pyrimidin-4-one

Systemtic Name: 6-(diethoxymethyl)-2-(phenylmethylsulfanyl)-1H-pyrimidin-4-one Openeye Name: 2-benzylsulfanyl-6-(diethoxymethyl)-1H-pyrimidin-4-one CAS Name: 6-(diethoxymethyl)-2-(phenylmethylthio)-1H-pyrimidin-4-one IUPAC Name: 2-benzylsulfanyl-6-(diethoxymethyl)-1H-pyrimidin-4-one Traditional Name: 2-(benzylthio)-6-(diethoxymethyl)-1H-pyrimidin-4-one Formula: C16H20N2O3S MolecularWeight: 320.4066

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(C1=CC(=O)N=C(N1)SCC2=CC=CC=C2)OCC

Isomeric SMILES

CCOC(C1=CC(=O)N=C(N1)SCC2=CC=CC=C2)OCC

InChI

InChI=1S/C16H20N2O3S/c1-3-20-15(21-4-2)13-10-14(19)18-16(17-13)22-11-12-8-6-5-7-9-12/h5-10,15H,3-4,11H2,1-2H3,(H,17,18,19)