2-(2,2-dimethoxyethylsulfanyl)-5-ethyl-6-(phenylmethyl)-1H-pyrimidin-4-one

Systemtic Name: 2-(2,2-dimethoxyethylsulfanyl)-5-ethyl-6-(phenylmethyl)-1H-pyrimidin-4-one Openeye Name: 6-benzyl-2-(2,2-dimethoxyethylsulfanyl)-5-ethyl-1H-pyrimidin-4-one CAS Name: 2-(2,2-dimethoxyethylthio)-5-ethyl-6-(phenylmethyl)-1H-pyrimidin-4-one IUPAC Name: 6-benzyl-2-(2,2-dimethoxyethylsulfanyl)-5-ethyl-1H-pyrimidin-4-one Traditional Name: 6-benzyl-2-(2,2-dimethoxyethylthio)-5-ethyl-1H-pyrimidin-4-one Formula: C17H22N2O3S MolecularWeight: 334.43318

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(NC(=NC1=O)SCC(OC)OC)CC2=CC=CC=C2

Isomeric SMILES

CCC1=C(NC(=NC1=O)SCC(OC)OC)CC2=CC=CC=C2

InChI

InChI=1S/C17H22N2O3S/c1-4-13-14(10-12-8-6-5-7-9-12)18-17(19-16(13)20)23-11-15(21-2)22-3/h5-9,15H,4,10-11H2,1-3H3,(H,18,19,20)