5-(phenylmethyl)-2-(phenylmethylsulfanyl)-1H-pyrimidin-6-one

Systemtic Name: 5-(phenylmethyl)-2-(phenylmethylsulfanyl)-1H-pyrimidin-6-one Openeye Name: 5-benzyl-2-benzylsulfanyl-1H-pyrimidin-6-one CAS Name: 5-(phenylmethyl)-2-(phenylmethylthio)-1H-pyrimidin-6-one IUPAC Name: 5-benzyl-2-benzylsulfanyl-1H-pyrimidin-6-one Traditional Name: 5-benzyl-2-(benzylthio)-1H-pyrimidin-6-one Formula: C18H16N2OS MolecularWeight: 308.39744

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CC2=CN=C(NC2=O)SCC3=CC=CC=C3

Isomeric SMILES

C1=CC=C(C=C1)CC2=CN=C(NC2=O)SCC3=CC=CC=C3

InChI

InChI=1S/C18H16N2OS/c21-17-16(11-14-7-3-1-4-8-14)12-19-18(20-17)22-13-15-9-5-2-6-10-15/h1-10,12H,11,13H2,(H,19,20,21)