2-butylsulfanyl-6-methyl-5-[(4-methylphenyl)methyl]-1H-pyrimidin-4-one

Systemtic Name: 2-butylsulfanyl-6-methyl-5-[(4-methylphenyl)methyl]-1H-pyrimidin-4-one Openeye Name: 2-butylsulfanyl-6-methyl-5-(p-tolylmethyl)-1H-pyrimidin-4-one CAS Name: 2-(butylthio)-6-methyl-5-[(4-methylphenyl)methyl]-1H-pyrimidin-4-one IUPAC Name: 2-butylsulfanyl-6-methyl-5-[(4-methylphenyl)methyl]-1H-pyrimidin-4-one Traditional Name: 2-(butylthio)-6-methyl-5-(4-methylbenzyl)-1H-pyrimidin-4-one Formula: C17H22N2OS MolecularWeight: 302.43438

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Descriptors Computed from Structure

Canonical SMILES:

CCCCSC1=NC(=O)C(=C(N1)C)CC2=CC=C(C=C2)C

Isomeric SMILES

CCCCSC1=NC(=O)C(=C(N1)C)CC2=CC=C(C=C2)C

InChI

InChI=1S/C17H22N2OS/c1-4-5-10-21-17-18-13(3)15(16(20)19-17)11-14-8-6-12(2)7-9-14/h6-9H,4-5,10-11H2,1-3H3,(H,18,19,20)