2-(2-methylprop-2-enylsulfanyl)-6-phenyl-5-(phenylmethyl)-1H-pyrimidin-4-one

Systemtic Name: 2-(2-methylprop-2-enylsulfanyl)-6-phenyl-5-(phenylmethyl)-1H-pyrimidin-4-one Openeye Name: 5-benzyl-2-(2-methylallylsulfanyl)-6-phenyl-1H-pyrimidin-4-one CAS Name: 2-(2-methylprop-2-enylthio)-6-phenyl-5-(phenylmethyl)-1H-pyrimidin-4-one IUPAC Name: 5-benzyl-2-(2-methylprop-2-enylsulfanyl)-6-phenyl-1H-pyrimidin-4-one Traditional Name: 5-benzyl-2-(2-methylallylthio)-6-phenyl-1H-pyrimidin-4-one Formula: C21H20N2OS MolecularWeight: 348.4613

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Descriptors Computed from Structure

Canonical SMILES:

CC(=C)CSC1=NC(=O)C(=C(N1)C2=CC=CC=C2)CC3=CC=CC=C3

Isomeric SMILES

CC(=C)CSC1=NC(=O)C(=C(N1)C2=CC=CC=C2)CC3=CC=CC=C3

InChI

InChI=1S/C21H20N2OS/c1-15(2)14-25-21-22-19(17-11-7-4-8-12-17)18(20(24)23-21)13-16-9-5-3-6-10-16/h3-12H,1,13-14H2,2H3,(H,22,23,24)