2-azanyl-6-(2-oxidanylidene-2-piperidin-1-yl-ethyl)sulfanyl-pyridin-1-ium-3,5-dicarbonitrile

Systemtic Name: 2-azanyl-6-(2-oxidanylidene-2-piperidin-1-yl-ethyl)sulfanyl-pyridin-1-ium-3,5-dicarbonitrile Openeye Name: 2-amino-6-[2-oxo-2-(1-piperidyl)ethyl]sulfanyl-pyridin-1-ium-3,5-dicarbonitrile CAS Name: 2-amino-6-[[2-oxo-2-(1-piperidinyl)ethyl]thio]pyridin-1-ium-3,5-dicarbonitrile IUPAC Name: 2-amino-6-(2-oxo-2-piperidin-1-ylethyl)sulfanylpyridin-1-ium-3,5-dicarbonitrile Traditional Name: 2-amino-6-[(2-keto-2-piperidino-ethyl)thio]pyridin-1-ium-3,5-dicarbonitrile Formula: C14H16N5OS+ MolecularWeight: 302.37474

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)C(=O)CSC2=C(C=C(C(=[NH+]2)N)C#N)C#N

Isomeric SMILES

C1CCN(CC1)C(=O)CSC2=C(C=C(C(=[NH+]2)N)C#N)C#N

InChI

InChI=1S/C14H15N5OS/c15-7-10-6-11(8-16)14(18-13(10)17)21-9-12(20)19-4-2-1-3-5-19/h6H,1-5,9H2,(H2,17,18)/p+1