methyl 5-[(4-ethylphenyl)methylamino]-3-(2-methoxyethanoylamino)-1-methyl-pyrrolo[2,3-b]pyridine-2-carboxylate

Systemtic Name: methyl 5-[(4-ethylphenyl)methylamino]-3-(2-methoxyethanoylamino)-1-methyl-pyrrolo[2,3-b]pyridine-2-carboxylate Openeye Name: methyl 5-[(4-ethylphenyl)methylamino]-3-[(2-methoxyacetyl)amino]-1-methyl-pyrrolo[2,3-b]pyridine-2-carboxylate CAS Name: 5-[(4-ethylphenyl)methylamino]-3-[(2-methoxy-1-oxoethyl)amino]-1-methyl-2-pyrrolo[2,3-b]pyridinecarboxylic acid methyl ester IUPAC Name: methyl 5-[(4-ethylphenyl)methylamino]-3-[(2-methoxyacetyl)amino]-1-methylpyrrolo[2,3-b]pyridine-2-carboxylate Traditional Name: 5-[(4-ethylbenzyl)amino]-3-[(2-methoxyacetyl)amino]-1-methyl-pyrrolo[2,3-b]pyridine-2-carboxylic acid methyl ester Formula: C22H26N4O4 MolecularWeight: 410.46624

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)CNC2=CN=C3C(=C2)C(=C(N3C)C(=O)OC)NC(=O)COC

Isomeric SMILES

CCC1=CC=C(C=C1)CNC2=CN=C3C(=C2)C(=C(N3C)C(=O)OC)NC(=O)COC

InChI

InChI=1S/C22H26N4O4/c1-5-14-6-8-15(9-7-14)11-23-16-10-17-19(25-18(27)13-29-3)20(22(28)30-4)26(2)21(17)24-12-16/h6-10,12,23H,5,11,13H2,1-4H3,(H,25,27)