methyl 1-ethyl-3-(oxolan-3-ylcarbonylamino)-5-(2-phenylpropylamino)pyrrolo[2,3-b]pyridine-2-carboxylate

Systemtic Name: methyl 1-ethyl-3-(oxolan-3-ylcarbonylamino)-5-(2-phenylpropylamino)pyrrolo[2,3-b]pyridine-2-carboxylate Openeye Name: methyl 1-ethyl-5-(2-phenylpropylamino)-3-(tetrahydrofuran-3-carbonylamino)pyrrolo[2,3-b]pyridine-2-carboxylate CAS Name: 1-ethyl-3-[[oxo(3-oxolanyl)methyl]amino]-5-(2-phenylpropylamino)-2-pyrrolo[2,3-b]pyridinecarboxylic acid methyl ester IUPAC Name: methyl 1-ethyl-3-(oxolane-3-carbonylamino)-5-(2-phenylpropylamino)pyrrolo[2,3-b]pyridine-2-carboxylate Traditional Name: 1-ethyl-5-(2-phenylpropylamino)-3-(tetrahydrofuran-3-carbonylamino)pyrrolo[2,3-b]pyridine-2-carboxylic acid methyl ester Formula: C25H30N4O4 MolecularWeight: 450.5301

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=C(C2=CC(=CN=C21)NCC(C)C3=CC=CC=C3)NC(=O)C4CCOC4)C(=O)OC

Isomeric SMILES

CCN1C(=C(C2=CC(=CN=C21)NCC(C)C3=CC=CC=C3)NC(=O)C4CCOC4)C(=O)OC

InChI

InChI=1S/C25H30N4O4/c1-4-29-22(25(31)32-3)21(28-24(30)18-10-11-33-15-18)20-12-19(14-27-23(20)29)26-13-16(2)17-8-6-5-7-9-17/h5-9,12,14,16,18,26H,4,10-11,13,15H2,1-3H3,(H,28,30)