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

Systemtic Name: 2-(2,2-diethoxyethylsulfanyl)-6-(phenylmethyl)-5-propan-2-yl-1H-pyrimidin-4-one Openeye Name: 6-benzyl-2-(2,2-diethoxyethylsulfanyl)-5-isopropyl-1H-pyrimidin-4-one CAS Name: 2-(2,2-diethoxyethylthio)-6-(phenylmethyl)-5-propan-2-yl-1H-pyrimidin-4-one IUPAC Name: 6-benzyl-2-(2,2-diethoxyethylsulfanyl)-5-propan-2-yl-1H-pyrimidin-4-one Traditional Name: 6-benzyl-2-(2,2-diethoxyethylthio)-5-isopropyl-1H-pyrimidin-4-one Formula: C20H28N2O3S MolecularWeight: 376.51292

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(CSC1=NC(=O)C(=C(N1)CC2=CC=CC=C2)C(C)C)OCC

Isomeric SMILES

CCOC(CSC1=NC(=O)C(=C(N1)CC2=CC=CC=C2)C(C)C)OCC

InChI

InChI=1S/C20H28N2O3S/c1-5-24-17(25-6-2)13-26-20-21-16(12-15-10-8-7-9-11-15)18(14(3)4)19(23)22-20/h7-11,14,17H,5-6,12-13H2,1-4H3,(H,21,22,23)