5-chloranyl-1-[phenyl-(phenylmethylsulfanyl)methyl]pyrimidin-2-one

Systemtic Name: 5-chloranyl-1-[phenyl-(phenylmethylsulfanyl)methyl]pyrimidin-2-one Openeye Name: 1-[benzylsulfanyl(phenyl)methyl]-5-chloro-pyrimidin-2-one CAS Name: 5-chloro-1-[phenyl-(phenylmethylthio)methyl]-2-pyrimidinone IUPAC Name: 1-[benzylsulfanyl(phenyl)methyl]-5-chloropyrimidin-2-one Traditional Name: 1-[(benzylthio)-phenyl-methyl]-5-chloro-pyrimidin-2-one Formula: C18H15ClN2OS MolecularWeight: 342.8425

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CSC(C2=CC=CC=C2)N3C=C(C=NC3=O)Cl

Isomeric SMILES

C1=CC=C(C=C1)CSC(C2=CC=CC=C2)N3C=C(C=NC3=O)Cl

InChI

InChI=1S/C18H15ClN2OS/c19-16-11-20-18(22)21(12-16)17(15-9-5-2-6-10-15)23-13-14-7-3-1-4-8-14/h1-12,17H,13H2