N-ethyl-3-(4-nitrophenyl)-3-oxidanylidene-2-(3-phenylpyridin-1-ium-1-yl)propanimidothioate

Systemtic Name: N-ethyl-3-(4-nitrophenyl)-3-oxidanylidene-2-(3-phenylpyridin-1-ium-1-yl)propanimidothioate Openeye Name: N-ethyl-3-(4-nitrophenyl)-3-oxo-2-(3-phenylpyridin-1-ium-1-yl)propanimidothioate CAS Name: N-ethyl-3-(4-nitrophenyl)-3-oxo-2-(3-phenyl-1-pyridin-1-iumyl)propanimidothioate IUPAC Name: N-ethyl-3-(4-nitrophenyl)-3-oxo-2-(3-phenylpyridin-1-ium-1-yl)propanimidothioate Traditional Name: N-ethyl-3-keto-3-(4-nitrophenyl)-2-(3-phenylpyridin-1-ium-1-yl)thiopropionimidate Formula: C22H19N3O3S MolecularWeight: 405.46956

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Descriptors Computed from Structure

Canonical SMILES:

CCN=C(C(C(=O)C1=CC=C(C=C1)[N+](=O)[O-])[N+]2=CC=CC(=C2)C3=CC=CC=C3)[S-]

Isomeric SMILES

CCN=C(C(C(=O)C1=CC=C(C=C1)[N+](=O)[O-])[N+]2=CC=CC(=C2)C3=CC=CC=C3)[S-]

InChI

InChI=1S/C22H19N3O3S/c1-2-23-22(29)20(21(26)17-10-12-19(13-11-17)25(27)28)24-14-6-9-18(15-24)16-7-4-3-5-8-16/h3-15,20H,2H2,1H3