ethyl 2-[(1-ethyl-6-phenyl-pyrazolo[3,4-b]pyridin-4-yl)carbonylamino]-4-methyl-5-(methylcarbamoyl)thiophene-3-carboxylate

Systemtic Name: ethyl 2-[(1-ethyl-6-phenyl-pyrazolo[3,4-b]pyridin-4-yl)carbonylamino]-4-methyl-5-(methylcarbamoyl)thiophene-3-carboxylate Openeye Name: ethyl 2-[(1-ethyl-6-phenyl-pyrazolo[3,4-b]pyridine-4-carbonyl)amino]-4-methyl-5-(methylcarbamoyl)thiophene-3-carboxylate CAS Name: 2-[[(1-ethyl-6-phenyl-4-pyrazolo[3,4-b]pyridinyl)-oxomethyl]amino]-4-methyl-5-(methylcarbamoyl)-3-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 2-[(1-ethyl-6-phenylpyrazolo[3,4-b]pyridine-4-carbonyl)amino]-4-methyl-5-(methylcarbamoyl)thiophene-3-carboxylate Traditional Name: 2-[(1-ethyl-6-phenyl-pyrazolo[3,4-b]pyridine-4-carbonyl)amino]-4-methyl-5-(methylcarbamoyl)thiophene-3-carboxylic acid ethyl ester Formula: C25H25N5O4S MolecularWeight: 491.5621

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCN1C2=C(C=N1)C(=CC(=N2)C3=CC=CC=C3)C(=O)NC4=C(C(=C(S4)C(=O)NC)C)C(=O)OCC

Isomeric SMILES

CCN1C2=C(C=N1)C(=CC(=N2)C3=CC=CC=C3)C(=O)NC4=C(C(=C(S4)C(=O)NC)C)C(=O)OCC

InChI

InChI=1S/C25H25N5O4S/c1-5-30-21-17(13-27-30)16(12-18(28-21)15-10-8-7-9-11-15)22(31)29-24-19(25(33)34-6-2)14(3)20(35-24)23(32)26-4/h7-13H,5-6H2,1-4H3,(H,26,32)(H,29,31)