ethyl 3-(dimethylaminomethylideneamino)-5-nitro-thieno[2,3-b]pyridine-2-carboxylate

Systemtic Name: ethyl 3-(dimethylaminomethylideneamino)-5-nitro-thieno[2,3-b]pyridine-2-carboxylate Openeye Name: ethyl 3-(dimethylaminomethyleneamino)-5-nitro-thieno[2,3-b]pyridine-2-carboxylate CAS Name: 3-(dimethylaminomethylideneamino)-5-nitro-2-thieno[2,3-b]pyridinecarboxylic acid ethyl ester IUPAC Name: ethyl 3-(dimethylaminomethylideneamino)-5-nitrothieno[2,3-b]pyridine-2-carboxylate Traditional Name: 3-(dimethylaminomethyleneamino)-5-nitro-thieno[2,3-b]pyridine-2-carboxylic acid ethyl ester Formula: C13H14N4O4S MolecularWeight: 322.33966

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C2=CC(=CN=C2S1)[N+](=O)[O-])N=CN(C)C

Isomeric SMILES

CCOC(=O)C1=C(C2=CC(=CN=C2S1)[N+](=O)[O-])N=CN(C)C

InChI

InChI=1S/C13H14N4O4S/c1-4-21-13(18)11-10(15-7-16(2)3)9-5-8(17(19)20)6-14-12(9)22-11/h5-7H,4H2,1-3H3