1-(3-chloranyl-4-methoxy-phenyl)-3-(phenylmethylsulfanyl)pyrazin-2-one

Systemtic Name: 1-(3-chloranyl-4-methoxy-phenyl)-3-(phenylmethylsulfanyl)pyrazin-2-one Openeye Name: 3-benzylsulfanyl-1-(3-chloro-4-methoxy-phenyl)pyrazin-2-one CAS Name: 1-(3-chloro-4-methoxyphenyl)-3-(phenylmethylthio)-2-pyrazinone IUPAC Name: 3-benzylsulfanyl-1-(3-chloro-4-methoxyphenyl)pyrazin-2-one Traditional Name: 3-(benzylthio)-1-(3-chloro-4-methoxy-phenyl)pyrazin-2-one Formula: C18H15ClN2O2S MolecularWeight: 358.8419

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)N2C=CN=C(C2=O)SCC3=CC=CC=C3)Cl

Isomeric SMILES

COC1=C(C=C(C=C1)N2C=CN=C(C2=O)SCC3=CC=CC=C3)Cl

InChI

InChI=1S/C18H15ClN2O2S/c1-23-16-8-7-14(11-15(16)19)21-10-9-20-17(18(21)22)24-12-13-5-3-2-4-6-13/h2-11H,12H2,1H3