ethyl 3-azanyl-4-(dimethylamino)thieno[2,3-b]pyridin-7-ium-2-carboxylate

Systemtic Name: ethyl 3-azanyl-4-(dimethylamino)thieno[2,3-b]pyridin-7-ium-2-carboxylate Openeye Name: ethyl 3-amino-4-(dimethylamino)thieno[2,3-b]pyridin-7-ium-2-carboxylate CAS Name: 3-amino-4-(dimethylamino)-2-thieno[2,3-b]pyridin-7-iumcarboxylic acid ethyl ester IUPAC Name: ethyl 3-amino-4-(dimethylamino)thieno[2,3-b]pyridin-7-ium-2-carboxylate Traditional Name: 3-amino-4-(dimethylamino)thieno[2,3-b]pyridin-7-ium-2-carboxylic acid ethyl ester Formula: C12H16N3O2S+ MolecularWeight: 266.33934

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C2=C(C=C[NH+]=C2S1)N(C)C)N

Isomeric SMILES

CCOC(=O)C1=C(C2=C(C=C[NH+]=C2S1)N(C)C)N

InChI

InChI=1S/C12H15N3O2S/c1-4-17-12(16)10-9(13)8-7(15(2)3)5-6-14-11(8)18-10/h5-6H,4,13H2,1-3H3/p+1