N-[4-tert-butyl-3-(3-pyrrolidin-1-ylpropyl)phenyl]-2-(pyridin-4-ylmethylamino)pyridine-3-carboxamide

Systemtic Name: N-[4-tert-butyl-3-(3-pyrrolidin-1-ylpropyl)phenyl]-2-(pyridin-4-ylmethylamino)pyridine-3-carboxamide Openeye Name: N-[4-tert-butyl-3-(3-pyrrolidin-1-ylpropyl)phenyl]-2-(4-pyridylmethylamino)pyridine-3-carboxamide CAS Name: N-[4-tert-butyl-3-[3-(1-pyrrolidinyl)propyl]phenyl]-2-(pyridin-4-ylmethylamino)-3-pyridinecarboxamide IUPAC Name: N-[4-tert-butyl-3-(3-pyrrolidin-1-ylpropyl)phenyl]-2-(pyridin-4-ylmethylamino)pyridine-3-carboxamide Traditional Name: N-[4-tert-butyl-3-(3-pyrrolidinopropyl)phenyl]-2-(4-pyridylmethylamino)nicotinamide Formula: C29H37N5O MolecularWeight: 471.63698

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=C(C=C(C=C1)NC(=O)C2=C(N=CC=C2)NCC3=CC=NC=C3)CCCN4CCCC4

Isomeric SMILES

CC(C)(C)C1=C(C=C(C=C1)NC(=O)C2=C(N=CC=C2)NCC3=CC=NC=C3)CCCN4CCCC4

InChI

InChI=1S/C29H37N5O/c1-29(2,3)26-11-10-24(20-23(26)8-7-19-34-17-4-5-18-34)33-28(35)25-9-6-14-31-27(25)32-21-22-12-15-30-16-13-22/h6,9-16,20H,4-5,7-8,17-19,21H2,1-3H3,(H,31,32)(H,33,35)