2-[2-oxidanylidene-2-(4-phenylphenyl)ethyl]sulfanyl-6-propyl-1H-pyrimidin-4-one

Systemtic Name: 2-[2-oxidanylidene-2-(4-phenylphenyl)ethyl]sulfanyl-6-propyl-1H-pyrimidin-4-one Openeye Name: 2-[2-oxo-2-(4-phenylphenyl)ethyl]sulfanyl-6-propyl-1H-pyrimidin-4-one CAS Name: 2-[[2-oxo-2-(4-phenylphenyl)ethyl]thio]-6-propyl-1H-pyrimidin-4-one IUPAC Name: 2-[2-oxo-2-(4-phenylphenyl)ethyl]sulfanyl-6-propyl-1H-pyrimidin-4-one Traditional Name: 2-[[2-keto-2-(4-phenylphenyl)ethyl]thio]-6-propyl-1H-pyrimidin-4-one Formula: C21H20N2O2S MolecularWeight: 364.4607

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=CC(=O)N=C(N1)SCC(=O)C2=CC=C(C=C2)C3=CC=CC=C3

Isomeric SMILES

CCCC1=CC(=O)N=C(N1)SCC(=O)C2=CC=C(C=C2)C3=CC=CC=C3

InChI

InChI=1S/C21H20N2O2S/c1-2-6-18-13-20(25)23-21(22-18)26-14-19(24)17-11-9-16(10-12-17)15-7-4-3-5-8-15/h3-5,7-13H,2,6,14H2,1H3,(H,22,23,25)