N-[4-[(2-methyl-6-piperidin-1-yl-pyrimidin-4-yl)amino]phenyl]-1,3-benzodioxole-5-carboxamide

Systemtic Name: N-[4-[(2-methyl-6-piperidin-1-yl-pyrimidin-4-yl)amino]phenyl]-1,3-benzodioxole-5-carboxamide Openeye Name: N-[4-[[2-methyl-6-(1-piperidyl)pyrimidin-4-yl]amino]phenyl]-1,3-benzodioxole-5-carboxamide CAS Name: N-[4-[[2-methyl-6-(1-piperidinyl)-4-pyrimidinyl]amino]phenyl]-1,3-benzodioxole-5-carboxamide IUPAC Name: N-[4-[(2-methyl-6-piperidin-1-ylpyrimidin-4-yl)amino]phenyl]-1,3-benzodioxole-5-carboxamide Traditional Name: N-[4-[(2-methyl-6-piperidino-pyrimidin-4-yl)amino]phenyl]-piperonylamide Formula: C24H25N5O3 MolecularWeight: 431.487

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=CC(=N1)NC2=CC=C(C=C2)NC(=O)C3=CC4=C(C=C3)OCO4)N5CCCCC5

Isomeric SMILES

CC1=NC(=CC(=N1)NC2=CC=C(C=C2)NC(=O)C3=CC4=C(C=C3)OCO4)N5CCCCC5

InChI

InChI=1S/C24H25N5O3/c1-16-25-22(14-23(26-16)29-11-3-2-4-12-29)27-18-6-8-19(9-7-18)28-24(30)17-5-10-20-21(13-17)32-15-31-20/h5-10,13-14H,2-4,11-12,15H2,1H3,(H,28,30)(H,25,26,27)