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

Systemtic Name: ethyl 3,6-bis(azanyl)-5-cyano-4-(4-ethoxyphenyl)thieno[2,3-b]pyridine-2-carboxylate Openeye Name: ethyl 3,6-diamino-5-cyano-4-(4-ethoxyphenyl)thieno[2,3-b]pyridine-2-carboxylate CAS Name: 3,6-diamino-5-cyano-4-(4-ethoxyphenyl)-2-thieno[2,3-b]pyridinecarboxylic acid ethyl ester IUPAC Name: ethyl 3,6-diamino-5-cyano-4-(4-ethoxyphenyl)thieno[2,3-b]pyridine-2-carboxylate Traditional Name: 3,6-diamino-5-cyano-4-p-phenetyl-thieno[2,3-b]pyridine-2-carboxylic acid ethyl ester Formula: C19H18N4O3S MolecularWeight: 382.43622

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)C2=C(C(=NC3=C2C(=C(S3)C(=O)OCC)N)N)C#N

Isomeric SMILES

CCOC1=CC=C(C=C1)C2=C(C(=NC3=C2C(=C(S3)C(=O)OCC)N)N)C#N

InChI

InChI=1S/C19H18N4O3S/c1-3-25-11-7-5-10(6-8-11)13-12(9-20)17(22)23-18-14(13)15(21)16(27-18)19(24)26-4-2/h5-8H,3-4,21H2,1-2H3,(H2,22,23)