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

Systemtic Name: N-ethyl-3-oxidanylidene-3-(4-phenylphenyl)-2-pyridin-1-ium-1-yl-propanimidothioate Openeye Name: N-ethyl-3-oxo-3-(4-phenylphenyl)-2-pyridin-1-ium-1-yl-propanimidothioate CAS Name: N-ethyl-3-oxo-3-(4-phenylphenyl)-2-(1-pyridin-1-iumyl)propanimidothioate IUPAC Name: N-ethyl-3-oxo-3-(4-phenylphenyl)-2-pyridin-1-ium-1-ylpropanimidothioate Traditional Name: N-ethyl-3-keto-3-(4-phenylphenyl)-2-pyridin-1-ium-1-yl-thiopropionimidate Formula: C22H20N2OS MolecularWeight: 360.472

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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)[S-]

Isomeric SMILES

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

InChI

InChI=1S/C22H20N2OS/c1-2-23-22(26)20(24-15-7-4-8-16-24)21(25)19-13-11-18(12-14-19)17-9-5-3-6-10-17/h3-16,20H,2H2,1H3