2-(azepan-1-ium-1-ylidenemethylamino)-5,5,7,7-tetramethyl-4,6-dihydrothieno[2,3-c]pyridin-6-ium-3-carbonitrile

Systemtic Name: 2-(azepan-1-ium-1-ylidenemethylamino)-5,5,7,7-tetramethyl-4,6-dihydrothieno[2,3-c]pyridin-6-ium-3-carbonitrile Openeye Name: 2-(azepan-1-ium-1-ylidenemethylamino)-5,5,7,7-tetramethyl-4,6-dihydrothieno[2,3-c]pyridin-6-ium-3-carbonitrile CAS Name: 2-(1-azepan-1-iumylidenemethylamino)-5,5,7,7-tetramethyl-4,6-dihydrothieno[2,3-c]pyridin-6-ium-3-carbonitrile IUPAC Name: 2-(azepan-1-ium-1-ylidenemethylamino)-5,5,7,7-tetramethyl-4,6-dihydrothieno[2,3-c]pyridin-6-ium-3-carbonitrile Traditional Name: 2-(azepan-1-ium-1-ylidenemethylamino)-5,5,7,7-tetramethyl-4,6-dihydrothieno[2,3-c]pyridin-6-ium-3-carbonitrile Formula: C19H30N4S+2 MolecularWeight: 346.5333

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CC2=C(C([NH2+]1)(C)C)SC(=C2C#N)NC=[N+]3CCCCCC3)C

Isomeric SMILES

CC1(CC2=C(C([NH2+]1)(C)C)SC(=C2C#N)NC=[N+]3CCCCCC3)C

InChI

InChI=1S/C19H28N4S/c1-18(2)11-14-15(12-20)17(24-16(14)19(3,4)22-18)21-13-23-9-7-5-6-8-10-23/h13,22H,5-11H2,1-4H3/p+2