6-[(E)-hydroxyiminomethyl]-2-(naphthalen-2-ylmethylsulfanyl)-1H-pyrimidin-4-one

Systemtic Name: 6-[(E)-hydroxyiminomethyl]-2-(naphthalen-2-ylmethylsulfanyl)-1H-pyrimidin-4-one Openeye Name: (6E)-2-(2-naphthylmethylsulfanyl)-4-oxo-1H-pyrimidine-6-carbaldehyde oxime CAS Name: (6E)-2-(2-naphthalenylmethylthio)-4-oxo-1H-pyrimidine-6-carboxaldehyde oxime IUPAC Name: 6-[(E)-hydroxyiminomethyl]-2-(naphthalen-2-ylmethylsulfanyl)-1H-pyrimidin-4-one Traditional Name: (6E)-4-keto-2-(2-naphthylmethylthio)-1H-pyrimidine-6-carbaldehyde oxime Formula: C16H13N3O2S MolecularWeight: 311.35832

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C=C(C=CC2=C1)CSC3=NC(=O)C=C(N3)C=NO

Isomeric SMILES

C1=CC=C2C=C(C=CC2=C1)CSC3=NC(=O)C=C(N3)/C=N/O

InChI

InChI=1S/C16H13N3O2S/c20-15-8-14(9-17-21)18-16(19-15)22-10-11-5-6-12-3-1-2-4-13(12)7-11/h1-9,21H,10H2,(H,18,19,20)/b17-9+