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

Systemtic Name: methyl 3-(2-methoxyethanoylamino)-1-methyl-5-(4-pyrazol-1-ylbutan-2-ylamino)pyrrolo[2,3-b]pyridine-2-carboxylate Openeye Name: methyl 3-[(2-methoxyacetyl)amino]-1-methyl-5-[(1-methyl-3-pyrazol-1-yl-propyl)amino]pyrrolo[2,3-b]pyridine-2-carboxylate CAS Name: 3-[(2-methoxy-1-oxoethyl)amino]-1-methyl-5-[4-(1-pyrazolyl)butan-2-ylamino]-2-pyrrolo[2,3-b]pyridinecarboxylic acid methyl ester IUPAC Name: methyl 3-[(2-methoxyacetyl)amino]-1-methyl-5-(4-pyrazol-1-ylbutan-2-ylamino)pyrrolo[2,3-b]pyridine-2-carboxylate Traditional Name: 3-[(2-methoxyacetyl)amino]-1-methyl-5-[(1-methyl-3-pyrazol-1-yl-propyl)amino]pyrrolo[2,3-b]pyridine-2-carboxylic acid methyl ester Formula: C20H26N6O4 MolecularWeight: 414.45824

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H26N6O4/c1-13(6-9-26-8-5-7-22-26)23-14-10-15-17(24-16(27)12-29-3)18(20(28)30-4)25(2)19(15)21-11-14/h5,7-8,10-11,13,23H,6,9,12H2,1-4H3,(H,24,27)