methyl 5-[(6-methylpyridin-2-yl)methylamino]-3-(oxolan-3-ylcarbonylamino)-1-phenethyl-pyrrolo[2,3-b]pyridine-2-carboxylate

Systemtic Name: methyl 5-[(6-methylpyridin-2-yl)methylamino]-3-(oxolan-3-ylcarbonylamino)-1-phenethyl-pyrrolo[2,3-b]pyridine-2-carboxylate Openeye Name: methyl 5-[(6-methyl-2-pyridyl)methylamino]-1-phenethyl-3-(tetrahydrofuran-3-carbonylamino)pyrrolo[2,3-b]pyridine-2-carboxylate CAS Name: 5-[(6-methyl-2-pyridinyl)methylamino]-3-[[oxo(3-oxolanyl)methyl]amino]-1-phenethyl-2-pyrrolo[2,3-b]pyridinecarboxylic acid methyl ester IUPAC Name: methyl 5-[(6-methylpyridin-2-yl)methylamino]-3-(oxolane-3-carbonylamino)-1-phenethylpyrrolo[2,3-b]pyridine-2-carboxylate Traditional Name: 5-[(6-methyl-2-pyridyl)methylamino]-1-phenethyl-3-(tetrahydrofuran-3-carbonylamino)pyrrolo[2,3-b]pyridine-2-carboxylic acid methyl ester Formula: C29H31N5O4 MolecularWeight: 513.58754

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=CC=C1)CNC2=CN=C3C(=C2)C(=C(N3CCC4=CC=CC=C4)C(=O)OC)NC(=O)C5CCOC5

Isomeric SMILES

CC1=NC(=CC=C1)CNC2=CN=C3C(=C2)C(=C(N3CCC4=CC=CC=C4)C(=O)OC)NC(=O)C5CCOC5

InChI

InChI=1S/C29H31N5O4/c1-19-7-6-10-22(32-19)16-30-23-15-24-25(33-28(35)21-12-14-38-18-21)26(29(36)37-2)34(27(24)31-17-23)13-11-20-8-4-3-5-9-20/h3-10,15,17,21,30H,11-14,16,18H2,1-2H3,(H,33,35)