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

Systemtic Name: methyl 3,6-bis(azanyl)-5-cyano-4-(4-propan-2-ylphenyl)thieno[2,3-b]pyridine-2-carboxylate Openeye Name: methyl 3,6-diamino-5-cyano-4-(4-isopropylphenyl)thieno[2,3-b]pyridine-2-carboxylate CAS Name: 3,6-diamino-5-cyano-4-(4-propan-2-ylphenyl)-2-thieno[2,3-b]pyridinecarboxylic acid methyl ester IUPAC Name: methyl 3,6-diamino-5-cyano-4-(4-propan-2-ylphenyl)thieno[2,3-b]pyridine-2-carboxylate Traditional Name: 3,6-diamino-5-cyano-4-p-cumenyl-thieno[2,3-b]pyridine-2-carboxylic acid methyl ester Formula: C19H18N4O2S MolecularWeight: 366.43682

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H18N4O2S/c1-9(2)10-4-6-11(7-5-10)13-12(8-20)17(22)23-18-14(13)15(21)16(26-18)19(24)25-3/h4-7,9H,21H2,1-3H3,(H2,22,23)