N-(3-cyano-5,5,7,7-tetramethyl-4,6-dihydrothieno[2,3-c]pyridin-6-ium-2-yl)-4-pyrrolidin-1-ylsulfonyl-benzamide

Systemtic Name: N-(3-cyano-5,5,7,7-tetramethyl-4,6-dihydrothieno[2,3-c]pyridin-6-ium-2-yl)-4-pyrrolidin-1-ylsulfonyl-benzamide Openeye Name: N-(3-cyano-5,5,7,7-tetramethyl-4,6-dihydrothieno[2,3-c]pyridin-6-ium-2-yl)-4-pyrrolidin-1-ylsulfonyl-benzamide CAS Name: N-(3-cyano-5,5,7,7-tetramethyl-4,6-dihydrothieno[2,3-c]pyridin-6-ium-2-yl)-4-(1-pyrrolidinylsulfonyl)benzamide IUPAC Name: N-(3-cyano-5,5,7,7-tetramethyl-4,6-dihydrothieno[2,3-c]pyridin-6-ium-2-yl)-4-pyrrolidin-1-ylsulfonylbenzamide Traditional Name: N-(3-cyano-5,5,7,7-tetramethyl-4,6-dihydrothieno[2,3-c]pyridin-6-ium-2-yl)-4-pyrrolidinosulfonyl-benzamide Formula: C23H29N4O3S2+ MolecularWeight: 473.63136

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CC2=C(C([NH2+]1)(C)C)SC(=C2C#N)NC(=O)C3=CC=C(C=C3)S(=O)(=O)N4CCCC4)C

Isomeric SMILES

CC1(CC2=C(C([NH2+]1)(C)C)SC(=C2C#N)NC(=O)C3=CC=C(C=C3)S(=O)(=O)N4CCCC4)C

InChI

InChI=1S/C23H28N4O3S2/c1-22(2)13-17-18(14-24)21(31-19(17)23(3,4)26-22)25-20(28)15-7-9-16(10-8-15)32(29,30)27-11-5-6-12-27/h7-10,26H,5-6,11-13H2,1-4H3,(H,25,28)/p+1