6-methyl-5-(phenylmethyl)-2-(pyridin-3-ylmethylsulfanyl)-1H-pyrimidin-4-one

Systemtic Name: 6-methyl-5-(phenylmethyl)-2-(pyridin-3-ylmethylsulfanyl)-1H-pyrimidin-4-one Openeye Name: 5-benzyl-6-methyl-2-(3-pyridylmethylsulfanyl)-1H-pyrimidin-4-one CAS Name: 6-methyl-5-(phenylmethyl)-2-(3-pyridinylmethylthio)-1H-pyrimidin-4-one IUPAC Name: 5-benzyl-6-methyl-2-(pyridin-3-ylmethylsulfanyl)-1H-pyrimidin-4-one Traditional Name: 5-benzyl-6-methyl-2-(3-pyridylmethylthio)-1H-pyrimidin-4-one Formula: C18H17N3OS MolecularWeight: 323.41208

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)N=C(N1)SCC2=CN=CC=C2)CC3=CC=CC=C3

Isomeric SMILES

CC1=C(C(=O)N=C(N1)SCC2=CN=CC=C2)CC3=CC=CC=C3

InChI

InChI=1S/C18H17N3OS/c1-13-16(10-14-6-3-2-4-7-14)17(22)21-18(20-13)23-12-15-8-5-9-19-11-15/h2-9,11H,10,12H2,1H3,(H,20,21,22)