3-[(E)-hydroxyiminomethyl]-2-(phenylmethylsulfanyl)pyrido[1,2-a]pyrimidin-4-one

Systemtic Name: 3-[(E)-hydroxyiminomethyl]-2-(phenylmethylsulfanyl)pyrido[1,2-a]pyrimidin-4-one Openeye Name: (3E)-2-benzylsulfanyl-4-oxo-pyrido[1,2-a]pyrimidine-3-carbaldehyde oxime CAS Name: (3E)-4-oxo-2-(phenylmethylthio)-3-pyrido[1,2-a]pyrimidinecarboxaldehyde oxime IUPAC Name: 2-benzylsulfanyl-3-[(E)-hydroxyiminomethyl]pyrido[1,2-a]pyrimidin-4-one Traditional Name: (3E)-2-(benzylthio)-4-keto-pyrido[1,2-a]pyrimidine-3-carbaldehyde oxime Formula: C16H13N3O2S MolecularWeight: 311.35832

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CSC2=C(C(=O)N3C=CC=CC3=N2)C=NO

Isomeric SMILES

C1=CC=C(C=C1)CSC2=C(C(=O)N3C=CC=CC3=N2)/C=N/O

InChI

InChI=1S/C16H13N3O2S/c20-16-13(10-17-21)15(18-14-8-4-5-9-19(14)16)22-11-12-6-2-1-3-7-12/h1-10,21H,11H2/b17-10+