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

Systemtic Name: methyl 3,6-bis(azanyl)-5-cyano-4-(3-hydroxyphenyl)thieno[2,3-b]pyridine-2-carboxylate Openeye Name: methyl 3,6-diamino-5-cyano-4-(3-hydroxyphenyl)thieno[2,3-b]pyridine-2-carboxylate CAS Name: 3,6-diamino-5-cyano-4-(3-hydroxyphenyl)-2-thieno[2,3-b]pyridinecarboxylic acid methyl ester IUPAC Name: methyl 3,6-diamino-5-cyano-4-(3-hydroxyphenyl)thieno[2,3-b]pyridine-2-carboxylate Traditional Name: 3,6-diamino-5-cyano-4-(3-hydroxyphenyl)thieno[2,3-b]pyridine-2-carboxylic acid methyl ester Formula: C16H12N4O3S MolecularWeight: 340.35648

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H12N4O3S/c1-23-16(22)13-12(18)11-10(7-3-2-4-8(21)5-7)9(6-17)14(19)20-15(11)24-13/h2-5,21H,18H2,1H3,(H2,19,20)