2-morpholin-4-yl-N-[4-(piperidin-1-ylmethyl)phenyl]pyrimidine-5-carboxamide

Systemtic Name: 2-morpholin-4-yl-N-[4-(piperidin-1-ylmethyl)phenyl]pyrimidine-5-carboxamide Openeye Name: 2-morpholino-N-[4-(1-piperidylmethyl)phenyl]pyrimidine-5-carboxamide CAS Name: 2-(4-morpholinyl)-N-[4-(1-piperidinylmethyl)phenyl]-5-pyrimidinecarboxamide IUPAC Name: 2-morpholin-4-yl-N-[4-(piperidin-1-ylmethyl)phenyl]pyrimidine-5-carboxamide Traditional Name: 2-morpholino-N-[4-(piperidinomethyl)phenyl]pyrimidine-5-carboxamide Formula: C21H27N5O2 MolecularWeight: 381.47138

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)CC2=CC=C(C=C2)NC(=O)C3=CN=C(N=C3)N4CCOCC4

Isomeric SMILES

C1CCN(CC1)CC2=CC=C(C=C2)NC(=O)C3=CN=C(N=C3)N4CCOCC4

InChI

InChI=1S/C21H27N5O2/c27-20(18-14-22-21(23-15-18)26-10-12-28-13-11-26)24-19-6-4-17(5-7-19)16-25-8-2-1-3-9-25/h4-7,14-15H,1-3,8-13,16H2,(H,24,27)