2-[2-oxidanylidene-2-(pyridin-2-ylamino)ethyl]sulfanyl-6-phenyl-pyrimidin-4-olate

Systemtic Name: 2-[2-oxidanylidene-2-(pyridin-2-ylamino)ethyl]sulfanyl-6-phenyl-pyrimidin-4-olate Openeye Name: 2-[2-oxo-2-(2-pyridylamino)ethyl]sulfanyl-6-phenyl-pyrimidin-4-olate CAS Name: 2-[[2-oxo-2-(2-pyridinylamino)ethyl]thio]-6-phenyl-4-pyrimidinolate IUPAC Name: 2-[2-oxo-2-(pyridin-2-ylamino)ethyl]sulfanyl-6-phenylpyrimidin-4-olate Traditional Name: 2-[[2-keto-2-(2-pyridylamino)ethyl]thio]-6-phenyl-pyrimidin-4-olate Formula: C17H13N4O2S- MolecularWeight: 337.37572

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=CC(=NC(=N2)SCC(=O)NC3=CC=CC=N3)[O-]

Isomeric SMILES

C1=CC=C(C=C1)C2=CC(=NC(=N2)SCC(=O)NC3=CC=CC=N3)[O-]

InChI

InChI=1S/C17H14N4O2S/c22-15-10-13(12-6-2-1-3-7-12)19-17(21-15)24-11-16(23)20-14-8-4-5-9-18-14/h1-10H,11H2,(H,18,20,23)(H,19,21,22)/p-1