methyl 5-(butan-2-ylamino)-3-(2-methoxyethanoylamino)-1-methyl-pyrrolo[2,3-b]pyridine-2-carboxylate

Systemtic Name: methyl 5-(butan-2-ylamino)-3-(2-methoxyethanoylamino)-1-methyl-pyrrolo[2,3-b]pyridine-2-carboxylate Openeye Name: methyl 3-[(2-methoxyacetyl)amino]-1-methyl-5-(sec-butylamino)pyrrolo[2,3-b]pyridine-2-carboxylate CAS Name: 5-(butan-2-ylamino)-3-[(2-methoxy-1-oxoethyl)amino]-1-methyl-2-pyrrolo[2,3-b]pyridinecarboxylic acid methyl ester IUPAC Name: methyl 5-(butan-2-ylamino)-3-[(2-methoxyacetyl)amino]-1-methylpyrrolo[2,3-b]pyridine-2-carboxylate Traditional Name: 3-[(2-methoxyacetyl)amino]-1-methyl-5-(sec-butylamino)pyrrolo[2,3-b]pyridine-2-carboxylic acid methyl ester Formula: C17H24N4O4 MolecularWeight: 348.39686

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)NC1=CN=C2C(=C1)C(=C(N2C)C(=O)OC)NC(=O)COC

Isomeric SMILES

CCC(C)NC1=CN=C2C(=C1)C(=C(N2C)C(=O)OC)NC(=O)COC

InChI

InChI=1S/C17H24N4O4/c1-6-10(2)19-11-7-12-14(20-13(22)9-24-4)15(17(23)25-5)21(3)16(12)18-8-11/h7-8,10,19H,6,9H2,1-5H3,(H,20,22)