methyl 5-[(4-ethoxyphenyl)methylamino]-1-ethyl-3-(furan-3-ylcarbonylamino)pyrrolo[2,3-b]pyridine-2-carboxylate

Systemtic Name: methyl 5-[(4-ethoxyphenyl)methylamino]-1-ethyl-3-(furan-3-ylcarbonylamino)pyrrolo[2,3-b]pyridine-2-carboxylate Openeye Name: methyl 5-[(4-ethoxyphenyl)methylamino]-1-ethyl-3-(furan-3-carbonylamino)pyrrolo[2,3-b]pyridine-2-carboxylate CAS Name: 5-[(4-ethoxyphenyl)methylamino]-1-ethyl-3-[[3-furanyl(oxo)methyl]amino]-2-pyrrolo[2,3-b]pyridinecarboxylic acid methyl ester IUPAC Name: methyl 5-[(4-ethoxyphenyl)methylamino]-1-ethyl-3-(furan-3-carbonylamino)pyrrolo[2,3-b]pyridine-2-carboxylate Traditional Name: 5-[(4-ethoxybenzyl)amino]-1-ethyl-3-(3-furoylamino)pyrrolo[2,3-b]pyridine-2-carboxylic acid methyl ester Formula: C25H26N4O5 MolecularWeight: 462.49774

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=C(C2=CC(=CN=C21)NCC3=CC=C(C=C3)OCC)NC(=O)C4=COC=C4)C(=O)OC

Isomeric SMILES

CCN1C(=C(C2=CC(=CN=C21)NCC3=CC=C(C=C3)OCC)NC(=O)C4=COC=C4)C(=O)OC

InChI

InChI=1S/C25H26N4O5/c1-4-29-22(25(31)32-3)21(28-24(30)17-10-11-33-15-17)20-12-18(14-27-23(20)29)26-13-16-6-8-19(9-7-16)34-5-2/h6-12,14-15,26H,4-5,13H2,1-3H3,(H,28,30)