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

Systemtic Name: 2-(diethoxymethylsulfanyl)-5-ethyl-6-(naphthalen-1-ylmethyl)-1H-pyrimidin-4-one Openeye Name: 2-(diethoxymethylsulfanyl)-5-ethyl-6-(1-naphthylmethyl)-1H-pyrimidin-4-one CAS Name: 2-(diethoxymethylthio)-5-ethyl-6-(1-naphthalenylmethyl)-1H-pyrimidin-4-one IUPAC Name: 2-(diethoxymethylsulfanyl)-5-ethyl-6-(naphthalen-1-ylmethyl)-1H-pyrimidin-4-one Traditional Name: 2-(diethoxymethylthio)-5-ethyl-6-(1-naphthylmethyl)-1H-pyrimidin-4-one Formula: C22H26N2O3S MolecularWeight: 398.51844

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(NC(=NC1=O)SC(OCC)OCC)CC2=CC=CC3=CC=CC=C32

Isomeric SMILES

CCC1=C(NC(=NC1=O)SC(OCC)OCC)CC2=CC=CC3=CC=CC=C32

InChI

InChI=1S/C22H26N2O3S/c1-4-17-19(14-16-12-9-11-15-10-7-8-13-18(15)16)23-21(24-20(17)25)28-22(26-5-2)27-6-3/h7-13,22H,4-6,14H2,1-3H3,(H,23,24,25)