methyl 3-benzamido-5-(oxan-4-ylamino)-1-(oxolan-2-ylmethyl)pyrrolo[2,3-b]pyridine-2-carboxylate

Systemtic Name: methyl 3-benzamido-5-(oxan-4-ylamino)-1-(oxolan-2-ylmethyl)pyrrolo[2,3-b]pyridine-2-carboxylate Openeye Name: methyl 3-benzamido-1-(tetrahydrofuran-2-ylmethyl)-5-(tetrahydropyran-4-ylamino)pyrrolo[2,3-b]pyridine-2-carboxylate CAS Name: 3-benzamido-5-(4-oxanylamino)-1-(2-oxolanylmethyl)-2-pyrrolo[2,3-b]pyridinecarboxylic acid methyl ester IUPAC Name: methyl 3-benzamido-5-(oxan-4-ylamino)-1-(oxolan-2-ylmethyl)pyrrolo[2,3-b]pyridine-2-carboxylate Traditional Name: 3-benzamido-1-(tetrahydrofurfuryl)-5-(tetrahydropyran-4-ylamino)pyrrolo[2,3-b]pyridine-2-carboxylic acid methyl ester Formula: C26H30N4O5 MolecularWeight: 478.5402

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=C(C2=CC(=CN=C2N1CC3CCCO3)NC4CCOCC4)NC(=O)C5=CC=CC=C5

Isomeric SMILES

COC(=O)C1=C(C2=CC(=CN=C2N1CC3CCCO3)NC4CCOCC4)NC(=O)C5=CC=CC=C5

InChI

InChI=1S/C26H30N4O5/c1-33-26(32)23-22(29-25(31)17-6-3-2-4-7-17)21-14-19(28-18-9-12-34-13-10-18)15-27-24(21)30(23)16-20-8-5-11-35-20/h2-4,6-7,14-15,18,20,28H,5,8-13,16H2,1H3,(H,29,31)