2-(imidazo[1,2-a]pyridin-2-ylmethylsulfanyl)-4,6-dimethyl-pyridin-1-ium-3-carbonitrile

Systemtic Name: 2-(imidazo[1,2-a]pyridin-2-ylmethylsulfanyl)-4,6-dimethyl-pyridin-1-ium-3-carbonitrile Openeye Name: 2-(imidazo[1,2-a]pyridin-2-ylmethylsulfanyl)-4,6-dimethyl-pyridin-1-ium-3-carbonitrile CAS Name: 2-(2-imidazo[1,2-a]pyridinylmethylthio)-4,6-dimethyl-3-pyridin-1-iumcarbonitrile IUPAC Name: 2-(imidazo[1,2-a]pyridin-2-ylmethylsulfanyl)-4,6-dimethylpyridin-1-ium-3-carbonitrile Traditional Name: 2-(imidazo[1,2-a]pyridin-2-ylmethylthio)-4,6-dimethyl-pyridin-1-ium-3-carbonitrile Formula: C16H15N4S+ MolecularWeight: 295.3821

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=[NH+]C(=C1C#N)SCC2=CN3C=CC=CC3=N2)C

Isomeric SMILES

CC1=CC(=[NH+]C(=C1C#N)SCC2=CN3C=CC=CC3=N2)C

InChI

InChI=1S/C16H14N4S/c1-11-7-12(2)18-16(14(11)8-17)21-10-13-9-20-6-4-3-5-15(20)19-13/h3-7,9H,10H2,1-2H3/p+1