2-[(2,5-dimethylphenyl)methylsulfanyl]-6-phenyl-1H-pyrimidin-4-one

Systemtic Name: 2-[(2,5-dimethylphenyl)methylsulfanyl]-6-phenyl-1H-pyrimidin-4-one Openeye Name: 2-[(2,5-dimethylphenyl)methylsulfanyl]-6-phenyl-1H-pyrimidin-4-one CAS Name: 2-[(2,5-dimethylphenyl)methylthio]-6-phenyl-1H-pyrimidin-4-one IUPAC Name: 2-[(2,5-dimethylphenyl)methylsulfanyl]-6-phenyl-1H-pyrimidin-4-one Traditional Name: 2-[(2,5-dimethylbenzyl)thio]-6-phenyl-1H-pyrimidin-4-one Formula: C19H18N2OS MolecularWeight: 322.42402

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C)CSC2=NC(=O)C=C(N2)C3=CC=CC=C3

Isomeric SMILES

CC1=CC(=C(C=C1)C)CSC2=NC(=O)C=C(N2)C3=CC=CC=C3

InChI

InChI=1S/C19H18N2OS/c1-13-8-9-14(2)16(10-13)12-23-19-20-17(11-18(22)21-19)15-6-4-3-5-7-15/h3-11H,12H2,1-2H3,(H,20,21,22)