methyl 3,6-bis(azanyl)-5-cyano-4-(4-methoxy-3-oxidanyl-phenyl)thieno[2,3-b]pyridine-2-carboxylate

Systemtic Name: methyl 3,6-bis(azanyl)-5-cyano-4-(4-methoxy-3-oxidanyl-phenyl)thieno[2,3-b]pyridine-2-carboxylate Openeye Name: methyl 3,6-diamino-5-cyano-4-(3-hydroxy-4-methoxy-phenyl)thieno[2,3-b]pyridine-2-carboxylate CAS Name: 3,6-diamino-5-cyano-4-(3-hydroxy-4-methoxyphenyl)-2-thieno[2,3-b]pyridinecarboxylic acid methyl ester IUPAC Name: methyl 3,6-diamino-5-cyano-4-(3-hydroxy-4-methoxyphenyl)thieno[2,3-b]pyridine-2-carboxylate Traditional Name: 3,6-diamino-5-cyano-4-(3-hydroxy-4-methoxy-phenyl)thieno[2,3-b]pyridine-2-carboxylic acid methyl ester Formula: C17H14N4O4S MolecularWeight: 370.38246

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C2=C(C(=NC3=C2C(=C(S3)C(=O)OC)N)N)C#N)O

Isomeric SMILES

COC1=C(C=C(C=C1)C2=C(C(=NC3=C2C(=C(S3)C(=O)OC)N)N)C#N)O

InChI

InChI=1S/C17H14N4O4S/c1-24-10-4-3-7(5-9(10)22)11-8(6-18)15(20)21-16-12(11)13(19)14(26-16)17(23)25-2/h3-5,22H,19H2,1-2H3,(H2,20,21)