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

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

Systemtic Name:2-butan-2-ylsulfanyl-5-ethyl-6-(naphthalen-1-ylmethyl)-1H-pyrimidin-4-one
Openeye Name:5-ethyl-6-(1-naphthylmethyl)-2-sec-butylsulfanyl-1H-pyrimidin-4-one
CAS Name:2-(butan-2-ylthio)-5-ethyl-6-(1-naphthalenylmethyl)-1H-pyrimidin-4-one
IUPAC Name:2-butan-2-ylsulfanyl-5-ethyl-6-(naphthalen-1-ylmethyl)-1H-pyrimidin-4-one
Traditional Name:5-ethyl-6-(1-naphthylmethyl)-2-(sec-butylthio)-1H-pyrimidin-4-one
Formula: C21H24N2OS
MolecularWeight: 352.49306
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Descriptors Computed from Structure

Canonical SMILES:

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


Isomeric SMILES

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


InChI

InChI=1S/C21H24N2OS/c1-4-14(3)25-21-22-19(17(5-2)20(24)23-21)13-16-11-8-10-15-9-6-7-12-18(15)16/h6-12,14H,4-5,13H2,1-3H3,(H,22,23,24)


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