2-[2-(3,4-dimethylphenyl)-2-oxidanylidene-ethyl]sulfanyl-6-phenyl-1H-pyrimidin-4-one

Systemtic Name: 2-[2-(3,4-dimethylphenyl)-2-oxidanylidene-ethyl]sulfanyl-6-phenyl-1H-pyrimidin-4-one Openeye Name: 2-[2-(3,4-dimethylphenyl)-2-oxo-ethyl]sulfanyl-6-phenyl-1H-pyrimidin-4-one CAS Name: 2-[[2-(3,4-dimethylphenyl)-2-oxoethyl]thio]-6-phenyl-1H-pyrimidin-4-one IUPAC Name: 2-[2-(3,4-dimethylphenyl)-2-oxoethyl]sulfanyl-6-phenyl-1H-pyrimidin-4-one Traditional Name: 2-[[2-(3,4-dimethylphenyl)-2-keto-ethyl]thio]-6-phenyl-1H-pyrimidin-4-one Formula: C20H18N2O2S MolecularWeight: 350.43412

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H18N2O2S/c1-13-8-9-16(10-14(13)2)18(23)12-25-20-21-17(11-19(24)22-20)15-6-4-3-5-7-15/h3-11H,12H2,1-2H3,(H,21,22,24)