3-ethyl-2-phenethylsulfanyl-6-phenyl-pyrimidin-4-one

Systemtic Name: 3-ethyl-2-phenethylsulfanyl-6-phenyl-pyrimidin-4-one Openeye Name: 3-ethyl-2-phenethylsulfanyl-6-phenyl-pyrimidin-4-one CAS Name: 3-ethyl-2-(phenethylthio)-6-phenyl-4-pyrimidinone IUPAC Name: 3-ethyl-2-phenethylsulfanyl-6-phenylpyrimidin-4-one Traditional Name: 3-ethyl-2-(phenethylthio)-6-phenyl-pyrimidin-4-one Formula: C20H20N2OS MolecularWeight: 336.4506

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=O)C=C(N=C1SCCC2=CC=CC=C2)C3=CC=CC=C3

Isomeric SMILES

CCN1C(=O)C=C(N=C1SCCC2=CC=CC=C2)C3=CC=CC=C3

InChI

InChI=1S/C20H20N2OS/c1-2-22-19(23)15-18(17-11-7-4-8-12-17)21-20(22)24-14-13-16-9-5-3-6-10-16/h3-12,15H,2,13-14H2,1H3