methyl 3-[(4-methoxyphenyl)carbonylamino]-1-methyl-5-(oxan-4-ylamino)pyrrolo[2,3-b]pyridine-2-carboxylate

Systemtic Name: methyl 3-[(4-methoxyphenyl)carbonylamino]-1-methyl-5-(oxan-4-ylamino)pyrrolo[2,3-b]pyridine-2-carboxylate Openeye Name: methyl 3-[(4-methoxybenzoyl)amino]-1-methyl-5-(tetrahydropyran-4-ylamino)pyrrolo[2,3-b]pyridine-2-carboxylate CAS Name: 3-[[(4-methoxyphenyl)-oxomethyl]amino]-1-methyl-5-(4-oxanylamino)-2-pyrrolo[2,3-b]pyridinecarboxylic acid methyl ester IUPAC Name: methyl 3-[(4-methoxybenzoyl)amino]-1-methyl-5-(oxan-4-ylamino)pyrrolo[2,3-b]pyridine-2-carboxylate Traditional Name: 1-methyl-3-(p-anisoylamino)-5-(tetrahydropyran-4-ylamino)pyrrolo[2,3-b]pyridine-2-carboxylic acid methyl ester Formula: C23H26N4O5 MolecularWeight: 438.47634

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=C(C2=CC(=CN=C21)NC3CCOCC3)NC(=O)C4=CC=C(C=C4)OC)C(=O)OC

Isomeric SMILES

CN1C(=C(C2=CC(=CN=C21)NC3CCOCC3)NC(=O)C4=CC=C(C=C4)OC)C(=O)OC

InChI

InChI=1S/C23H26N4O5/c1-27-20(23(29)31-3)19(26-22(28)14-4-6-17(30-2)7-5-14)18-12-16(13-24-21(18)27)25-15-8-10-32-11-9-15/h4-7,12-13,15,25H,8-11H2,1-3H3,(H,26,28)