6-(naphthalen-1-ylmethyl)-2-(2-oxidanylidenepropylsulfanyl)-5-propan-2-yl-1H-pyrimidin-4-one

Systemtic Name: 6-(naphthalen-1-ylmethyl)-2-(2-oxidanylidenepropylsulfanyl)-5-propan-2-yl-1H-pyrimidin-4-one Openeye Name: 2-acetonylsulfanyl-5-isopropyl-6-(1-naphthylmethyl)-1H-pyrimidin-4-one CAS Name: 6-(1-naphthalenylmethyl)-2-(2-oxopropylthio)-5-propan-2-yl-1H-pyrimidin-4-one IUPAC Name: 6-(naphthalen-1-ylmethyl)-2-(2-oxopropylsulfanyl)-5-propan-2-yl-1H-pyrimidin-4-one Traditional Name: 2-(acetonylthio)-5-isopropyl-6-(1-naphthylmethyl)-1H-pyrimidin-4-one Formula: C21H22N2O2S MolecularWeight: 366.47658

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=C(NC(=NC1=O)SCC(=O)C)CC2=CC=CC3=CC=CC=C32

Isomeric SMILES

CC(C)C1=C(NC(=NC1=O)SCC(=O)C)CC2=CC=CC3=CC=CC=C32

InChI

InChI=1S/C21H22N2O2S/c1-13(2)19-18(22-21(23-20(19)25)26-12-14(3)24)11-16-9-6-8-15-7-4-5-10-17(15)16/h4-10,13H,11-12H2,1-3H3,(H,22,23,25)