5-[(4-ethylphenyl)methyl]-6-methyl-2-[(2,4,6-trimethylphenyl)methylsulfanyl]-1H-pyrimidin-4-one

Systemtic Name: 5-[(4-ethylphenyl)methyl]-6-methyl-2-[(2,4,6-trimethylphenyl)methylsulfanyl]-1H-pyrimidin-4-one Openeye Name: 5-[(4-ethylphenyl)methyl]-6-methyl-2-[(2,4,6-trimethylphenyl)methylsulfanyl]-1H-pyrimidin-4-one CAS Name: 5-[(4-ethylphenyl)methyl]-6-methyl-2-[(2,4,6-trimethylphenyl)methylthio]-1H-pyrimidin-4-one IUPAC Name: 5-[(4-ethylphenyl)methyl]-6-methyl-2-[(2,4,6-trimethylphenyl)methylsulfanyl]-1H-pyrimidin-4-one Traditional Name: 5-(4-ethylbenzyl)-6-methyl-2-[(2,4,6-trimethylbenzyl)thio]-1H-pyrimidin-4-one Formula: C24H28N2OS MolecularWeight: 392.55692

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)CC2=C(NC(=NC2=O)SCC3=C(C=C(C=C3C)C)C)C

Isomeric SMILES

CCC1=CC=C(C=C1)CC2=C(NC(=NC2=O)SCC3=C(C=C(C=C3C)C)C)C

InChI

InChI=1S/C24H28N2OS/c1-6-19-7-9-20(10-8-19)13-21-18(5)25-24(26-23(21)27)28-14-22-16(3)11-15(2)12-17(22)4/h7-12H,6,13-14H2,1-5H3,(H,25,26,27)