N-(2-aminophenyl)-5-[[pyridin-3-ylcarbamoyl(3-pyrrolidin-1-ylpropyl)amino]methyl]pyridine-2-carboxamide

Systemtic Name: N-(2-aminophenyl)-5-[[pyridin-3-ylcarbamoyl(3-pyrrolidin-1-ylpropyl)amino]methyl]pyridine-2-carboxamide Openeye Name: N-(2-aminophenyl)-5-[[3-pyridylcarbamoyl(3-pyrrolidin-1-ylpropyl)amino]methyl]pyridine-2-carboxamide CAS Name: N-(2-aminophenyl)-5-[[[oxo-(3-pyridinylamino)methyl]-[3-(1-pyrrolidinyl)propyl]amino]methyl]-2-pyridinecarboxamide IUPAC Name: N-(2-aminophenyl)-5-[[pyridin-3-ylcarbamoyl(3-pyrrolidin-1-ylpropyl)amino]methyl]pyridine-2-carboxamide Traditional Name: N-(2-aminophenyl)-5-[[3-pyridylcarbamoyl(3-pyrrolidinopropyl)amino]methyl]picolinamide Formula: C26H31N7O2 MolecularWeight: 473.57004

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)CCCN(CC2=CN=C(C=C2)C(=O)NC3=CC=CC=C3N)C(=O)NC4=CN=CC=C4

Isomeric SMILES

C1CCN(C1)CCCN(CC2=CN=C(C=C2)C(=O)NC3=CC=CC=C3N)C(=O)NC4=CN=CC=C4

InChI

InChI=1S/C26H31N7O2/c27-22-8-1-2-9-23(22)31-25(34)24-11-10-20(17-29-24)19-33(16-6-15-32-13-3-4-14-32)26(35)30-21-7-5-12-28-18-21/h1-2,5,7-12,17-18H,3-4,6,13-16,19,27H2,(H,30,35)(H,31,34)