N-ethyl-2-(3-methylpyridin-1-ium-1-yl)-3-oxidanylidene-3-(4-phenylphenyl)propanimidothioate

Systemtic Name: N-ethyl-2-(3-methylpyridin-1-ium-1-yl)-3-oxidanylidene-3-(4-phenylphenyl)propanimidothioate Openeye Name: N-ethyl-2-(3-methylpyridin-1-ium-1-yl)-3-oxo-3-(4-phenylphenyl)propanimidothioate CAS Name: N-ethyl-2-(3-methyl-1-pyridin-1-iumyl)-3-oxo-3-(4-phenylphenyl)propanimidothioate IUPAC Name: N-ethyl-2-(3-methylpyridin-1-ium-1-yl)-3-oxo-3-(4-phenylphenyl)propanimidothioate Traditional Name: N-ethyl-3-keto-2-(3-methylpyridin-1-ium-1-yl)-3-(4-phenylphenyl)thiopropionimidate Formula: C23H22N2OS MolecularWeight: 374.49858

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Descriptors Computed from Structure

Canonical SMILES:

CCN=C(C(C(=O)C1=CC=C(C=C1)C2=CC=CC=C2)[N+]3=CC=CC(=C3)C)[S-]

Isomeric SMILES

CCN=C(C(C(=O)C1=CC=C(C=C1)C2=CC=CC=C2)[N+]3=CC=CC(=C3)C)[S-]

InChI

InChI=1S/C23H22N2OS/c1-3-24-23(27)21(25-15-7-8-17(2)16-25)22(26)20-13-11-19(12-14-20)18-9-5-4-6-10-18/h4-16,21H,3H2,1-2H3