methyl 3-(furan-2-ylcarbonylamino)-1-methyl-5-(4-pyrazol-1-ylbutan-2-ylamino)pyrrolo[2,3-b]pyridine-2-carboxylate

Systemtic Name: methyl 3-(furan-2-ylcarbonylamino)-1-methyl-5-(4-pyrazol-1-ylbutan-2-ylamino)pyrrolo[2,3-b]pyridine-2-carboxylate Openeye Name: methyl 3-(furan-2-carbonylamino)-1-methyl-5-[(1-methyl-3-pyrazol-1-yl-propyl)amino]pyrrolo[2,3-b]pyridine-2-carboxylate CAS Name: 3-[[2-furanyl(oxo)methyl]amino]-1-methyl-5-[4-(1-pyrazolyl)butan-2-ylamino]-2-pyrrolo[2,3-b]pyridinecarboxylic acid methyl ester IUPAC Name: methyl 3-(furan-2-carbonylamino)-1-methyl-5-(4-pyrazol-1-ylbutan-2-ylamino)pyrrolo[2,3-b]pyridine-2-carboxylate Traditional Name: 3-(2-furoylamino)-1-methyl-5-[(1-methyl-3-pyrazol-1-yl-propyl)amino]pyrrolo[2,3-b]pyridine-2-carboxylic acid methyl ester Formula: C22H24N6O4 MolecularWeight: 436.46376

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Descriptors Computed from Structure

Canonical SMILES:

CC(CCN1C=CC=N1)NC2=CN=C3C(=C2)C(=C(N3C)C(=O)OC)NC(=O)C4=CC=CO4

Isomeric SMILES

CC(CCN1C=CC=N1)NC2=CN=C3C(=C2)C(=C(N3C)C(=O)OC)NC(=O)C4=CC=CO4

InChI

InChI=1S/C22H24N6O4/c1-14(7-10-28-9-5-8-24-28)25-15-12-16-18(26-21(29)17-6-4-11-32-17)19(22(30)31-3)27(2)20(16)23-13-15/h4-6,8-9,11-14,25H,7,10H2,1-3H3,(H,26,29)