1-(phenylmethyl)-2-(phenylmethylsulfanyl)pyrimidin-4-one

Systemtic Name: 1-(phenylmethyl)-2-(phenylmethylsulfanyl)pyrimidin-4-one Openeye Name: 1-benzyl-2-benzylsulfanyl-pyrimidin-4-one CAS Name: 1-(phenylmethyl)-2-(phenylmethylthio)-4-pyrimidinone IUPAC Name: 1-benzyl-2-benzylsulfanylpyrimidin-4-one Traditional Name: 1-benzyl-2-(benzylthio)pyrimidin-4-one Formula: C18H16N2OS MolecularWeight: 308.39744

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CN2C=CC(=O)N=C2SCC3=CC=CC=C3

Isomeric SMILES

C1=CC=C(C=C1)CN2C=CC(=O)N=C2SCC3=CC=CC=C3

InChI

InChI=1S/C18H16N2OS/c21-17-11-12-20(13-15-7-3-1-4-8-15)18(19-17)22-14-16-9-5-2-6-10-16/h1-12H,13-14H2