4-methyl-5-(phenylcarbamoyl)-6-(phenylmethylsulfanyl)pyridin-2-olate

Systemtic Name: 4-methyl-5-(phenylcarbamoyl)-6-(phenylmethylsulfanyl)pyridin-2-olate Openeye Name: 6-benzylsulfanyl-4-methyl-5-(phenylcarbamoyl)pyridin-2-olate CAS Name: 5-[anilino(oxo)methyl]-4-methyl-6-(phenylmethylthio)-2-pyridinolate IUPAC Name: 6-benzylsulfanyl-4-methyl-5-(phenylcarbamoyl)pyridin-2-olate Traditional Name: 6-(benzylthio)-4-methyl-5-(phenylcarbamoyl)pyridin-2-olate Formula: C20H17N2O2S- MolecularWeight: 349.42618

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC(=C1C(=O)NC2=CC=CC=C2)SCC3=CC=CC=C3)[O-]

Isomeric SMILES

CC1=CC(=NC(=C1C(=O)NC2=CC=CC=C2)SCC3=CC=CC=C3)[O-]

InChI

InChI=1S/C20H18N2O2S/c1-14-12-17(23)22-20(25-13-15-8-4-2-5-9-15)18(14)19(24)21-16-10-6-3-7-11-16/h2-12H,13H2,1H3,(H,21,24)(H,22,23)/p-1