3-oxidanylidene-N-prop-2-enyl-2-pyridin-1-ium-1-yl-3-thiophen-2-yl-propanimidothioate

Systemtic Name: 3-oxidanylidene-N-prop-2-enyl-2-pyridin-1-ium-1-yl-3-thiophen-2-yl-propanimidothioate Openeye Name: N-allyl-3-oxo-2-pyridin-1-ium-1-yl-3-(2-thienyl)propanimidothioate CAS Name: 3-oxo-N-prop-2-enyl-2-(1-pyridin-1-iumyl)-3-thiophen-2-ylpropanimidothioate IUPAC Name: 3-oxo-N-prop-2-enyl-2-pyridin-1-ium-1-yl-3-thiophen-2-ylpropanimidothioate Traditional Name: N-allyl-3-keto-2-pyridin-1-ium-1-yl-3-(2-thienyl)thiopropionimidate Formula: C15H14N2OS2 MolecularWeight: 302.41446

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Descriptors Computed from Structure

Canonical SMILES:

C=CCN=C(C(C(=O)C1=CC=CS1)[N+]2=CC=CC=C2)[S-]

Isomeric SMILES

C=CCN=C(C(C(=O)C1=CC=CS1)[N+]2=CC=CC=C2)[S-]

InChI

InChI=1S/C15H14N2OS2/c1-2-8-16-15(19)13(17-9-4-3-5-10-17)14(18)12-7-6-11-20-12/h2-7,9-11,13H,1,8H2