5-methyl-6-(phenylmethyl)-2-phenylsulfanyl-1H-pyrimidin-4-one

Systemtic Name: 5-methyl-6-(phenylmethyl)-2-phenylsulfanyl-1H-pyrimidin-4-one Openeye Name: 6-benzyl-5-methyl-2-phenylsulfanyl-1H-pyrimidin-4-one CAS Name: 5-methyl-6-(phenylmethyl)-2-(phenylthio)-1H-pyrimidin-4-one IUPAC Name: 6-benzyl-5-methyl-2-phenylsulfanyl-1H-pyrimidin-4-one Traditional Name: 6-benzyl-5-methyl-2-(phenylthio)-1H-pyrimidin-4-one Formula: C18H16N2OS MolecularWeight: 308.39744

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(NC(=NC1=O)SC2=CC=CC=C2)CC3=CC=CC=C3

Isomeric SMILES

CC1=C(NC(=NC1=O)SC2=CC=CC=C2)CC3=CC=CC=C3

InChI

InChI=1S/C18H16N2OS/c1-13-16(12-14-8-4-2-5-9-14)19-18(20-17(13)21)22-15-10-6-3-7-11-15/h2-11H,12H2,1H3,(H,19,20,21)