N-[4-[(4-methyl-6-piperidin-1-yl-pyrimidin-2-yl)amino]phenyl]pentanamide

Systemtic Name: N-[4-[(4-methyl-6-piperidin-1-yl-pyrimidin-2-yl)amino]phenyl]pentanamide Openeye Name: N-[4-[[4-methyl-6-(1-piperidyl)pyrimidin-2-yl]amino]phenyl]pentanamide CAS Name: N-[4-[[4-methyl-6-(1-piperidinyl)-2-pyrimidinyl]amino]phenyl]pentanamide IUPAC Name: N-[4-[(4-methyl-6-piperidin-1-ylpyrimidin-2-yl)amino]phenyl]pentanamide Traditional Name: N-[4-[(4-methyl-6-piperidino-pyrimidin-2-yl)amino]phenyl]valeramide Formula: C21H29N5O MolecularWeight: 367.48786

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCC(=O)NC1=CC=C(C=C1)NC2=NC(=CC(=N2)N3CCCCC3)C

Isomeric SMILES

CCCCC(=O)NC1=CC=C(C=C1)NC2=NC(=CC(=N2)N3CCCCC3)C

InChI

InChI=1S/C21H29N5O/c1-3-4-8-20(27)23-17-9-11-18(12-10-17)24-21-22-16(2)15-19(25-21)26-13-6-5-7-14-26/h9-12,15H,3-8,13-14H2,1-2H3,(H,23,27)(H,22,24,25)