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

Systemtic Name: N-[4-tert-butyl-3-(3-pyrrolidin-3-ylpropyl)phenyl]-2-(pyridin-4-ylmethylamino)pyridine-3-carboxamide Openeye Name: N-[4-tert-butyl-3-(3-pyrrolidin-3-ylpropyl)phenyl]-2-(4-pyridylmethylamino)pyridine-3-carboxamide CAS Name: N-[4-tert-butyl-3-[3-(3-pyrrolidinyl)propyl]phenyl]-2-(pyridin-4-ylmethylamino)-3-pyridinecarboxamide IUPAC Name: N-[4-tert-butyl-3-(3-pyrrolidin-3-ylpropyl)phenyl]-2-(pyridin-4-ylmethylamino)pyridine-3-carboxamide Traditional Name: N-[4-tert-butyl-3-(3-pyrrolidin-3-ylpropyl)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)CCCC4CCNC4

Isomeric SMILES

CC(C)(C)C1=C(C=C(C=C1)NC(=O)C2=C(N=CC=C2)NCC3=CC=NC=C3)CCCC4CCNC4

InChI

InChI=1S/C29H37N5O/c1-29(2,3)26-10-9-24(18-23(26)7-4-6-21-13-17-31-19-21)34-28(35)25-8-5-14-32-27(25)33-20-22-11-15-30-16-12-22/h5,8-12,14-16,18,21,31H,4,6-7,13,17,19-20H2,1-3H3,(H,32,33)(H,34,35)