6-[(3-methylphenyl)methyl]-2-propan-2-ylsulfanyl-1H-pyrimidin-4-one

Systemtic Name: 6-[(3-methylphenyl)methyl]-2-propan-2-ylsulfanyl-1H-pyrimidin-4-one Openeye Name: 2-isopropylsulfanyl-6-(m-tolylmethyl)-1H-pyrimidin-4-one CAS Name: 6-[(3-methylphenyl)methyl]-2-(propan-2-ylthio)-1H-pyrimidin-4-one IUPAC Name: 6-[(3-methylphenyl)methyl]-2-propan-2-ylsulfanyl-1H-pyrimidin-4-one Traditional Name: 2-(isopropylthio)-6-(3-methylbenzyl)-1H-pyrimidin-4-one Formula: C15H18N2OS MolecularWeight: 274.38122

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)CC2=CC(=O)N=C(N2)SC(C)C

Isomeric SMILES

CC1=CC(=CC=C1)CC2=CC(=O)N=C(N2)SC(C)C

InChI

InChI=1S/C15H18N2OS/c1-10(2)19-15-16-13(9-14(18)17-15)8-12-6-4-5-11(3)7-12/h4-7,9-10H,8H2,1-3H3,(H,16,17,18)