5-nitro-6-piperidin-1-yl-N,N-bis(pyridin-2-ylmethyl)pyrimidin-4-amine

Systemtic Name: 5-nitro-6-piperidin-1-yl-N,N-bis(pyridin-2-ylmethyl)pyrimidin-4-amine Openeye Name: 5-nitro-6-(1-piperidyl)-N,N-bis(2-pyridylmethyl)pyrimidin-4-amine CAS Name: 5-nitro-6-(1-piperidinyl)-N,N-bis(2-pyridinylmethyl)-4-pyrimidinamine IUPAC Name: 5-nitro-6-piperidin-1-yl-N,N-bis(pyridin-2-ylmethyl)pyrimidin-4-amine Traditional Name: (5-nitro-6-piperidino-pyrimidin-4-yl)-bis(2-pyridylmethyl)amine Formula: C21H23N7O2 MolecularWeight: 405.45302

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)C2=C(C(=NC=N2)N(CC3=CC=CC=N3)CC4=CC=CC=N4)[N+](=O)[O-]

Isomeric SMILES

C1CCN(CC1)C2=C(C(=NC=N2)N(CC3=CC=CC=N3)CC4=CC=CC=N4)[N+](=O)[O-]

InChI

InChI=1S/C21H23N7O2/c29-28(30)19-20(26-12-6-1-7-13-26)24-16-25-21(19)27(14-17-8-2-4-10-22-17)15-18-9-3-5-11-23-18/h2-5,8-11,16H,1,6-7,12-15H2