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

Systemtic Name: methyl 5-(cyclobutylamino)-3-[(4-methoxyphenyl)carbonylamino]-1-methyl-pyrrolo[2,3-b]pyridine-2-carboxylate Openeye Name: methyl 5-(cyclobutylamino)-3-[(4-methoxybenzoyl)amino]-1-methyl-pyrrolo[2,3-b]pyridine-2-carboxylate CAS Name: 5-(cyclobutylamino)-3-[[(4-methoxyphenyl)-oxomethyl]amino]-1-methyl-2-pyrrolo[2,3-b]pyridinecarboxylic acid methyl ester IUPAC Name: methyl 5-(cyclobutylamino)-3-[(4-methoxybenzoyl)amino]-1-methylpyrrolo[2,3-b]pyridine-2-carboxylate Traditional Name: 5-(cyclobutylamino)-1-methyl-3-(p-anisoylamino)pyrrolo[2,3-b]pyridine-2-carboxylic acid methyl ester Formula: C22H24N4O4 MolecularWeight: 408.45036

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=C(C2=CC(=CN=C21)NC3CCC3)NC(=O)C4=CC=C(C=C4)OC)C(=O)OC

Isomeric SMILES

CN1C(=C(C2=CC(=CN=C21)NC3CCC3)NC(=O)C4=CC=C(C=C4)OC)C(=O)OC

InChI

InChI=1S/C22H24N4O4/c1-26-19(22(28)30-3)18(25-21(27)13-7-9-16(29-2)10-8-13)17-11-15(12-23-20(17)26)24-14-5-4-6-14/h7-12,14,24H,4-6H2,1-3H3,(H,25,27)