4-(4-nitrophenyl)-5-piperazin-1-yl-2,6-dipyrrolidin-1-yl-pyrimidine

Systemtic Name: 4-(4-nitrophenyl)-5-piperazin-1-yl-2,6-dipyrrolidin-1-yl-pyrimidine Openeye Name: 4-(4-nitrophenyl)-5-piperazin-1-yl-2,6-dipyrrolidin-1-yl-pyrimidine CAS Name: 4-(4-nitrophenyl)-5-(1-piperazinyl)-2,6-bis(1-pyrrolidinyl)pyrimidine IUPAC Name: 4-(4-nitrophenyl)-5-piperazin-1-yl-2,6-dipyrrolidin-1-ylpyrimidine Traditional Name: 4-(4-nitrophenyl)-5-piperazino-2,6-dipyrrolidino-pyrimidine Formula: C22H29N7O2 MolecularWeight: 423.51136

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)C2=NC(=NC(=C2N3CCNCC3)C4=CC=C(C=C4)[N+](=O)[O-])N5CCCC5

Isomeric SMILES

C1CCN(C1)C2=NC(=NC(=C2N3CCNCC3)C4=CC=C(C=C4)[N+](=O)[O-])N5CCCC5

InChI

InChI=1S/C22H29N7O2/c30-29(31)18-7-5-17(6-8-18)19-20(26-15-9-23-10-16-26)21(27-11-1-2-12-27)25-22(24-19)28-13-3-4-14-28/h5-8,23H,1-4,9-16H2