methyl 3-(oxolan-3-ylcarbonylamino)-1-phenethyl-5-(1-pyridin-3-ylpropan-2-ylamino)pyrrolo[2,3-b]pyridine-2-carboxylate

Systemtic Name: methyl 3-(oxolan-3-ylcarbonylamino)-1-phenethyl-5-(1-pyridin-3-ylpropan-2-ylamino)pyrrolo[2,3-b]pyridine-2-carboxylate Openeye Name: methyl 5-[[1-methyl-2-(3-pyridyl)ethyl]amino]-1-phenethyl-3-(tetrahydrofuran-3-carbonylamino)pyrrolo[2,3-b]pyridine-2-carboxylate CAS Name: 3-[[oxo(3-oxolanyl)methyl]amino]-1-phenethyl-5-[1-(3-pyridinyl)propan-2-ylamino]-2-pyrrolo[2,3-b]pyridinecarboxylic acid methyl ester IUPAC Name: methyl 3-(oxolane-3-carbonylamino)-1-phenethyl-5-(1-pyridin-3-ylpropan-2-ylamino)pyrrolo[2,3-b]pyridine-2-carboxylate Traditional Name: 5-[[1-methyl-2-(3-pyridyl)ethyl]amino]-1-phenethyl-3-(tetrahydrofuran-3-carbonylamino)pyrrolo[2,3-b]pyridine-2-carboxylic acid methyl ester Formula: C30H33N5O4 MolecularWeight: 527.61412

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Descriptors Computed from Structure

Canonical SMILES:

CC(CC1=CN=CC=C1)NC2=CN=C3C(=C2)C(=C(N3CCC4=CC=CC=C4)C(=O)OC)NC(=O)C5CCOC5

Isomeric SMILES

CC(CC1=CN=CC=C1)NC2=CN=C3C(=C2)C(=C(N3CCC4=CC=CC=C4)C(=O)OC)NC(=O)C5CCOC5

InChI

InChI=1S/C30H33N5O4/c1-20(15-22-9-6-12-31-17-22)33-24-16-25-26(34-29(36)23-11-14-39-19-23)27(30(37)38-2)35(28(25)32-18-24)13-10-21-7-4-3-5-8-21/h3-9,12,16-18,20,23,33H,10-11,13-15,19H2,1-2H3,(H,34,36)