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

Systemtic Name: methyl 3-[(1-ethyl-6-phenyl-pyrazolo[3,4-b]pyridin-4-yl)carbonylamino]thiophene-2-carboxylate Openeye Name: methyl 3-[(1-ethyl-6-phenyl-pyrazolo[3,4-b]pyridine-4-carbonyl)amino]thiophene-2-carboxylate CAS Name: 3-[[(1-ethyl-6-phenyl-4-pyrazolo[3,4-b]pyridinyl)-oxomethyl]amino]-2-thiophenecarboxylic acid methyl ester IUPAC Name: methyl 3-[(1-ethyl-6-phenylpyrazolo[3,4-b]pyridine-4-carbonyl)amino]thiophene-2-carboxylate Traditional Name: 3-[(1-ethyl-6-phenyl-pyrazolo[3,4-b]pyridine-4-carbonyl)amino]thiophene-2-carboxylic acid methyl ester Formula: C21H18N4O3S MolecularWeight: 406.45762

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C2=C(C=N1)C(=CC(=N2)C3=CC=CC=C3)C(=O)NC4=C(SC=C4)C(=O)OC

Isomeric SMILES

CCN1C2=C(C=N1)C(=CC(=N2)C3=CC=CC=C3)C(=O)NC4=C(SC=C4)C(=O)OC

InChI

InChI=1S/C21H18N4O3S/c1-3-25-19-15(12-22-25)14(11-17(23-19)13-7-5-4-6-8-13)20(26)24-16-9-10-29-18(16)21(27)28-2/h4-12H,3H2,1-2H3,(H,24,26)