4-[2-[(3-chlorophenyl)amino]pyrimidin-4-yl]-N-pentan-2-yl-pyridine-2-carboxamide

Systemtic Name: 4-[2-[(3-chlorophenyl)amino]pyrimidin-4-yl]-N-pentan-2-yl-pyridine-2-carboxamide Openeye Name: 4-[2-(3-chloroanilino)pyrimidin-4-yl]-N-(1-methylbutyl)pyridine-2-carboxamide CAS Name: 4-[2-(3-chloroanilino)-4-pyrimidinyl]-N-pentan-2-yl-2-pyridinecarboxamide IUPAC Name: 4-[2-(3-chloroanilino)pyrimidin-4-yl]-N-pentan-2-ylpyridine-2-carboxamide Traditional Name: 4-[2-(3-chloroanilino)pyrimidin-4-yl]-N-(1-methylbutyl)picolinamide Formula: C21H22ClN5O MolecularWeight: 395.88528

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(C)NC(=O)C1=NC=CC(=C1)C2=NC(=NC=C2)NC3=CC(=CC=C3)Cl

Isomeric SMILES

CCCC(C)NC(=O)C1=NC=CC(=C1)C2=NC(=NC=C2)NC3=CC(=CC=C3)Cl

InChI

InChI=1S/C21H22ClN5O/c1-3-5-14(2)25-20(28)19-12-15(8-10-23-19)18-9-11-24-21(27-18)26-17-7-4-6-16(22)13-17/h4,6-14H,3,5H2,1-2H3,(H,25,28)(H,24,26,27)