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

Systemtic Name: 2-(2,2-diethoxyethylsulfanyl)-5-ethyl-6-(phenylmethyl)-1H-pyrimidin-4-one Openeye Name: 6-benzyl-2-(2,2-diethoxyethylsulfanyl)-5-ethyl-1H-pyrimidin-4-one CAS Name: 2-(2,2-diethoxyethylthio)-5-ethyl-6-(phenylmethyl)-1H-pyrimidin-4-one IUPAC Name: 6-benzyl-2-(2,2-diethoxyethylsulfanyl)-5-ethyl-1H-pyrimidin-4-one Traditional Name: 6-benzyl-2-(2,2-diethoxyethylthio)-5-ethyl-1H-pyrimidin-4-one Formula: C19H26N2O3S MolecularWeight: 362.48634

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H26N2O3S/c1-4-15-16(12-14-10-8-7-9-11-14)20-19(21-18(15)22)25-13-17(23-5-2)24-6-3/h7-11,17H,4-6,12-13H2,1-3H3,(H,20,21,22)