2-(1,3-dioxolan-2-ylsulfanyl)-6-(phenylmethyl)-5-propan-2-yl-1H-pyrimidin-4-one

Systemtic Name: 2-(1,3-dioxolan-2-ylsulfanyl)-6-(phenylmethyl)-5-propan-2-yl-1H-pyrimidin-4-one Openeye Name: 6-benzyl-2-(1,3-dioxolan-2-ylsulfanyl)-5-isopropyl-1H-pyrimidin-4-one CAS Name: 2-(1,3-dioxolan-2-ylthio)-6-(phenylmethyl)-5-propan-2-yl-1H-pyrimidin-4-one IUPAC Name: 6-benzyl-2-(1,3-dioxolan-2-ylsulfanyl)-5-propan-2-yl-1H-pyrimidin-4-one Traditional Name: 6-benzyl-2-(1,3-dioxolan-2-ylthio)-5-isopropyl-1H-pyrimidin-4-one Formula: C17H20N2O3S MolecularWeight: 332.4173

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=C(NC(=NC1=O)SC2OCCO2)CC3=CC=CC=C3

Isomeric SMILES

CC(C)C1=C(NC(=NC1=O)SC2OCCO2)CC3=CC=CC=C3

InChI

InChI=1S/C17H20N2O3S/c1-11(2)14-13(10-12-6-4-3-5-7-12)18-16(19-15(14)20)23-17-21-8-9-22-17/h3-7,11,17H,8-10H2,1-2H3,(H,18,19,20)