5-[(4-ethylphenyl)methyl]-6-methyl-2-pentylsulfanyl-1H-pyrimidin-4-one

Systemtic Name: 5-[(4-ethylphenyl)methyl]-6-methyl-2-pentylsulfanyl-1H-pyrimidin-4-one Openeye Name: 5-[(4-ethylphenyl)methyl]-6-methyl-2-pentylsulfanyl-1H-pyrimidin-4-one CAS Name: 5-[(4-ethylphenyl)methyl]-6-methyl-2-(pentylthio)-1H-pyrimidin-4-one IUPAC Name: 5-[(4-ethylphenyl)methyl]-6-methyl-2-pentylsulfanyl-1H-pyrimidin-4-one Traditional Name: 2-(amylthio)-5-(4-ethylbenzyl)-6-methyl-1H-pyrimidin-4-one Formula: C19H26N2OS MolecularWeight: 330.48754

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCSC1=NC(=O)C(=C(N1)C)CC2=CC=C(C=C2)CC

Isomeric SMILES

CCCCCSC1=NC(=O)C(=C(N1)C)CC2=CC=C(C=C2)CC

InChI

InChI=1S/C19H26N2OS/c1-4-6-7-12-23-19-20-14(3)17(18(22)21-19)13-16-10-8-15(5-2)9-11-16/h8-11H,4-7,12-13H2,1-3H3,(H,20,21,22)