ethyl 3,6-bis(azanyl)-5-cyano-4-pyridin-3-yl-thieno[2,3-b]pyridine-2-carboxylate

Systemtic Name: ethyl 3,6-bis(azanyl)-5-cyano-4-pyridin-3-yl-thieno[2,3-b]pyridine-2-carboxylate Openeye Name: ethyl 3,6-diamino-5-cyano-4-(3-pyridyl)thieno[2,3-b]pyridine-2-carboxylate CAS Name: 3,6-diamino-5-cyano-4-(3-pyridinyl)-2-thieno[2,3-b]pyridinecarboxylic acid ethyl ester IUPAC Name: ethyl 3,6-diamino-5-cyano-4-pyridin-3-ylthieno[2,3-b]pyridine-2-carboxylate Traditional Name: 3,6-diamino-5-cyano-4-(3-pyridyl)thieno[2,3-b]pyridine-2-carboxylic acid ethyl ester Formula: C16H13N5O2S MolecularWeight: 339.37172

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C2=C(S1)N=C(C(=C2C3=CN=CC=C3)C#N)N)N

Isomeric SMILES

CCOC(=O)C1=C(C2=C(S1)N=C(C(=C2C3=CN=CC=C3)C#N)N)N

InChI

InChI=1S/C16H13N5O2S/c1-2-23-16(22)13-12(18)11-10(8-4-3-5-20-7-8)9(6-17)14(19)21-15(11)24-13/h3-5,7H,2,18H2,1H3,(H2,19,21)