N-[[[2-piperidin-1-yl-6-(2-pyrrolidin-1-ylethylamino)pyrimidin-4-yl]amino]methyl]benzamide

Systemtic Name: N-[[[2-piperidin-1-yl-6-(2-pyrrolidin-1-ylethylamino)pyrimidin-4-yl]amino]methyl]benzamide Openeye Name: N-[[[2-(1-piperidyl)-6-(2-pyrrolidin-1-ylethylamino)pyrimidin-4-yl]amino]methyl]benzamide CAS Name: N-[[[2-(1-piperidinyl)-6-[2-(1-pyrrolidinyl)ethylamino]-4-pyrimidinyl]amino]methyl]benzamide IUPAC Name: N-[[[2-piperidin-1-yl-6-(2-pyrrolidin-1-ylethylamino)pyrimidin-4-yl]amino]methyl]benzamide Traditional Name: N-[[[2-piperidino-6-(2-pyrrolidinoethylamino)pyrimidin-4-yl]amino]methyl]benzamide Formula: C23H33N7O MolecularWeight: 423.55442

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)C2=NC(=CC(=N2)NCNC(=O)C3=CC=CC=C3)NCCN4CCCC4

Isomeric SMILES

C1CCN(CC1)C2=NC(=CC(=N2)NCNC(=O)C3=CC=CC=C3)NCCN4CCCC4

InChI

InChI=1S/C23H33N7O/c31-22(19-9-3-1-4-10-19)26-18-25-21-17-20(24-11-16-29-12-7-8-13-29)27-23(28-21)30-14-5-2-6-15-30/h1,3-4,9-10,17H,2,5-8,11-16,18H2,(H,26,31)(H2,24,25,27,28)