(5-nitro-2-pyrrolidin-1-yl-phenyl)-(4-pyrimidin-2-ylpiperazin-1-yl)methanone

Systemtic Name: (5-nitro-2-pyrrolidin-1-yl-phenyl)-(4-pyrimidin-2-ylpiperazin-1-yl)methanone Openeye Name: (5-nitro-2-pyrrolidin-1-yl-phenyl)-(4-pyrimidin-2-ylpiperazin-1-yl)methanone CAS Name: [5-nitro-2-(1-pyrrolidinyl)phenyl]-[4-(2-pyrimidinyl)-1-piperazinyl]methanone IUPAC Name: (5-nitro-2-pyrrolidin-1-ylphenyl)-(4-pyrimidin-2-ylpiperazin-1-yl)methanone Traditional Name: (5-nitro-2-pyrrolidino-phenyl)-[4-(2-pyrimidyl)piperazino]methanone Formula: C19H22N6O3 MolecularWeight: 382.41638

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)C2=C(C=C(C=C2)[N+](=O)[O-])C(=O)N3CCN(CC3)C4=NC=CC=N4

Isomeric SMILES

C1CCN(C1)C2=C(C=C(C=C2)[N+](=O)[O-])C(=O)N3CCN(CC3)C4=NC=CC=N4

InChI

InChI=1S/C19H22N6O3/c26-18(23-10-12-24(13-11-23)19-20-6-3-7-21-19)16-14-15(25(27)28)4-5-17(16)22-8-1-2-9-22/h3-7,14H,1-2,8-13H2