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

Systemtic Name: 2-butan-2-ylsulfanyl-5-methyl-6-(naphthalen-1-ylmethyl)-1H-pyrimidin-4-one Openeye Name: 5-methyl-6-(1-naphthylmethyl)-2-sec-butylsulfanyl-1H-pyrimidin-4-one CAS Name: 2-(butan-2-ylthio)-5-methyl-6-(1-naphthalenylmethyl)-1H-pyrimidin-4-one IUPAC Name: 2-butan-2-ylsulfanyl-5-methyl-6-(naphthalen-1-ylmethyl)-1H-pyrimidin-4-one Traditional Name: 5-methyl-6-(1-naphthylmethyl)-2-(sec-butylthio)-1H-pyrimidin-4-one Formula: C20H22N2OS MolecularWeight: 338.46648

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)SC1=NC(=O)C(=C(N1)CC2=CC=CC3=CC=CC=C32)C

Isomeric SMILES

CCC(C)SC1=NC(=O)C(=C(N1)CC2=CC=CC3=CC=CC=C32)C

InChI

InChI=1S/C20H22N2OS/c1-4-13(2)24-20-21-18(14(3)19(23)22-20)12-16-10-7-9-15-8-5-6-11-17(15)16/h5-11,13H,4,12H2,1-3H3,(H,21,22,23)