ethyl 2-[(4-dimethylaminophenyl)carbonylamino]-5,5,7,7-tetramethyl-4,6-dihydrothieno[2,3-c]pyridin-6-ium-3-carboxylate

Systemtic Name: ethyl 2-[(4-dimethylaminophenyl)carbonylamino]-5,5,7,7-tetramethyl-4,6-dihydrothieno[2,3-c]pyridin-6-ium-3-carboxylate Openeye Name: ethyl 2-[[4-(dimethylamino)benzoyl]amino]-5,5,7,7-tetramethyl-4,6-dihydrothieno[2,3-c]pyridin-6-ium-3-carboxylate CAS Name: 2-[[(4-dimethylaminophenyl)-oxomethyl]amino]-5,5,7,7-tetramethyl-4,6-dihydrothieno[2,3-c]pyridin-6-ium-3-carboxylic acid ethyl ester IUPAC Name: ethyl 2-[[4-(dimethylamino)benzoyl]amino]-5,5,7,7-tetramethyl-4,6-dihydrothieno[2,3-c]pyridin-6-ium-3-carboxylate Traditional Name: 2-[[4-(dimethylamino)benzoyl]amino]-5,5,7,7-tetramethyl-4,6-dihydrothieno[2,3-c]pyridin-6-ium-3-carboxylic acid ethyl ester Formula: C23H32N3O3S+ MolecularWeight: 430.58348

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(SC2=C1CC([NH2+]C2(C)C)(C)C)NC(=O)C3=CC=C(C=C3)N(C)C

Isomeric SMILES

CCOC(=O)C1=C(SC2=C1CC([NH2+]C2(C)C)(C)C)NC(=O)C3=CC=C(C=C3)N(C)C

InChI

InChI=1S/C23H31N3O3S/c1-8-29-21(28)17-16-13-22(2,3)25-23(4,5)18(16)30-20(17)24-19(27)14-9-11-15(12-10-14)26(6)7/h9-12,25H,8,13H2,1-7H3,(H,24,27)/p+1