6-methyl-2-[2-[(2R)-1-methylpyrrolidin-1-ium-2-yl]ethylsulfanyl]pyridine-3-carbonitrile

Systemtic Name: 6-methyl-2-[2-[(2R)-1-methylpyrrolidin-1-ium-2-yl]ethylsulfanyl]pyridine-3-carbonitrile Openeye Name: 6-methyl-2-[2-[(2R)-1-methylpyrrolidin-1-ium-2-yl]ethylsulfanyl]pyridine-3-carbonitrile CAS Name: 6-methyl-2-[2-[(2R)-1-methyl-2-pyrrolidin-1-iumyl]ethylthio]-3-pyridinecarbonitrile IUPAC Name: 6-methyl-2-[2-[(2R)-1-methylpyrrolidin-1-ium-2-yl]ethylsulfanyl]pyridine-3-carbonitrile Traditional Name: 6-methyl-2-[2-[(2R)-1-methylpyrrolidin-1-ium-2-yl]ethylthio]nicotinonitrile Formula: C14H20N3S+ MolecularWeight: 262.3937

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=C(C=C1)C#N)SCCC2CCC[NH+]2C

Isomeric SMILES

CC1=NC(=C(C=C1)C#N)SCC[C@H]2CCC[NH+]2C

InChI

InChI=1S/C14H19N3S/c1-11-5-6-12(10-15)14(16-11)18-9-7-13-4-3-8-17(13)2/h5-6,13H,3-4,7-9H2,1-2H3/p+1/t13-/m1/s1