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

Systemtic Name: 2-(2,2-dimethoxyethylsulfanyl)-5-ethyl-6-(naphthalen-1-ylmethyl)-1H-pyrimidin-4-one Openeye Name: 2-(2,2-dimethoxyethylsulfanyl)-5-ethyl-6-(1-naphthylmethyl)-1H-pyrimidin-4-one CAS Name: 2-(2,2-dimethoxyethylthio)-5-ethyl-6-(1-naphthalenylmethyl)-1H-pyrimidin-4-one IUPAC Name: 2-(2,2-dimethoxyethylsulfanyl)-5-ethyl-6-(naphthalen-1-ylmethyl)-1H-pyrimidin-4-one Traditional Name: 2-(2,2-dimethoxyethylthio)-5-ethyl-6-(1-naphthylmethyl)-1H-pyrimidin-4-one Formula: C21H24N2O3S MolecularWeight: 384.49186

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(NC(=NC1=O)SCC(OC)OC)CC2=CC=CC3=CC=CC=C32

Isomeric SMILES

CCC1=C(NC(=NC1=O)SCC(OC)OC)CC2=CC=CC3=CC=CC=C32

InChI

InChI=1S/C21H24N2O3S/c1-4-16-18(12-15-10-7-9-14-8-5-6-11-17(14)15)22-21(23-20(16)24)27-13-19(25-2)26-3/h5-11,19H,4,12-13H2,1-3H3,(H,22,23,24)