methyl 1-ethyl-3-(oxolan-3-ylcarbonylamino)-5-[(1-phenylpyrazol-4-yl)methylamino]pyrrolo[2,3-b]pyridine-2-carboxylate

Systemtic Name: methyl 1-ethyl-3-(oxolan-3-ylcarbonylamino)-5-[(1-phenylpyrazol-4-yl)methylamino]pyrrolo[2,3-b]pyridine-2-carboxylate Openeye Name: methyl 1-ethyl-5-[(1-phenylpyrazol-4-yl)methylamino]-3-(tetrahydrofuran-3-carbonylamino)pyrrolo[2,3-b]pyridine-2-carboxylate CAS Name: 1-ethyl-3-[[oxo(3-oxolanyl)methyl]amino]-5-[(1-phenyl-4-pyrazolyl)methylamino]-2-pyrrolo[2,3-b]pyridinecarboxylic acid methyl ester IUPAC Name: methyl 1-ethyl-3-(oxolane-3-carbonylamino)-5-[(1-phenylpyrazol-4-yl)methylamino]pyrrolo[2,3-b]pyridine-2-carboxylate Traditional Name: 1-ethyl-5-[(1-phenylpyrazol-4-yl)methylamino]-3-(tetrahydrofuran-3-carbonylamino)pyrrolo[2,3-b]pyridine-2-carboxylic acid methyl ester Formula: C26H28N6O4 MolecularWeight: 488.53832

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=C(C2=CC(=CN=C21)NCC3=CN(N=C3)C4=CC=CC=C4)NC(=O)C5CCOC5)C(=O)OC

Isomeric SMILES

CCN1C(=C(C2=CC(=CN=C21)NCC3=CN(N=C3)C4=CC=CC=C4)NC(=O)C5CCOC5)C(=O)OC

InChI

InChI=1S/C26H28N6O4/c1-3-31-23(26(34)35-2)22(30-25(33)18-9-10-36-16-18)21-11-19(14-28-24(21)31)27-12-17-13-29-32(15-17)20-7-5-4-6-8-20/h4-8,11,13-15,18,27H,3,9-10,12,16H2,1-2H3,(H,30,33)