N-(4-tert-butylphenyl)-2-(pyrimidin-4-ylmethylamino)pyridine-3-carboxamide

Systemtic Name: N-(4-tert-butylphenyl)-2-(pyrimidin-4-ylmethylamino)pyridine-3-carboxamide Openeye Name: N-(4-tert-butylphenyl)-2-(pyrimidin-4-ylmethylamino)pyridine-3-carboxamide CAS Name: N-(4-tert-butylphenyl)-2-(4-pyrimidinylmethylamino)-3-pyridinecarboxamide IUPAC Name: N-(4-tert-butylphenyl)-2-(pyrimidin-4-ylmethylamino)pyridine-3-carboxamide Traditional Name: N-(4-tert-butylphenyl)-2-(4-pyrimidylmethylamino)nicotinamide Formula: C21H23N5O MolecularWeight: 361.44022

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H23N5O/c1-21(2,3)15-6-8-16(9-7-15)26-20(27)18-5-4-11-23-19(18)24-13-17-10-12-22-14-25-17/h4-12,14H,13H2,1-3H3,(H,23,24)(H,26,27)