4,6-dimethyl-1-[(4-phenyl-1,2,3,6-tetrahydropyridin-1-ium-1-yl)methyl]-2-sulfanylidene-pyridine-3-carbonitrile

Systemtic Name: 4,6-dimethyl-1-[(4-phenyl-1,2,3,6-tetrahydropyridin-1-ium-1-yl)methyl]-2-sulfanylidene-pyridine-3-carbonitrile Openeye Name: 4,6-dimethyl-1-[(4-phenyl-1,2,3,6-tetrahydropyridin-1-ium-1-yl)methyl]-2-thioxo-pyridine-3-carbonitrile CAS Name: 4,6-dimethyl-1-[(4-phenyl-1,2,3,6-tetrahydropyridin-1-ium-1-yl)methyl]-2-sulfanylidene-3-pyridinecarbonitrile IUPAC Name: 4,6-dimethyl-1-[(4-phenyl-1,2,3,6-tetrahydropyridin-1-ium-1-yl)methyl]-2-sulfanylidenepyridine-3-carbonitrile Traditional Name: 4,6-dimethyl-1-[(4-phenyl-1,2,3,6-tetrahydropyridin-1-ium-1-yl)methyl]-2-thioxo-nicotinonitrile Formula: C20H22N3S+ MolecularWeight: 336.47378

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C(=S)N1C[NH+]2CCC(=CC2)C3=CC=CC=C3)C#N)C

Isomeric SMILES

CC1=CC(=C(C(=S)N1C[NH+]2CCC(=CC2)C3=CC=CC=C3)C#N)C

InChI

InChI=1S/C20H21N3S/c1-15-12-16(2)23(20(24)19(15)13-21)14-22-10-8-18(9-11-22)17-6-4-3-5-7-17/h3-8,12H,9-11,14H2,1-2H3/p+1