5-(2-cyclopentylsulfanylethyl)-6-methyl-2-(3-methylbutylsulfanyl)-5H-pyrimidin-4-one

Systemtic Name: 5-(2-cyclopentylsulfanylethyl)-6-methyl-2-(3-methylbutylsulfanyl)-5H-pyrimidin-4-one Openeye Name: 5-(2-cyclopentylsulfanylethyl)-2-isopentylsulfanyl-6-methyl-5H-pyrimidin-4-one CAS Name: 5-[2-(cyclopentylthio)ethyl]-6-methyl-2-(3-methylbutylthio)-5H-pyrimidin-4-one IUPAC Name: 5-(2-cyclopentylsulfanylethyl)-6-methyl-2-(3-methylbutylsulfanyl)-5H-pyrimidin-4-one Traditional Name: 5-[2-(cyclopentylthio)ethyl]-2-(isoamylthio)-6-methyl-5H-pyrimidin-4-one Formula: C17H28N2OS2 MolecularWeight: 340.54702

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=NC(=O)C1CCSC2CCCC2)SCCC(C)C

Isomeric SMILES

CC1=NC(=NC(=O)C1CCSC2CCCC2)SCCC(C)C

InChI

InChI=1S/C17H28N2OS2/c1-12(2)8-10-22-17-18-13(3)15(16(20)19-17)9-11-21-14-6-4-5-7-14/h12,14-15H,4-11H2,1-3H3