4-[4-(diphenylmethyl)piperazin-1-yl]-5-nitro-6-pyrrolidin-1-yl-pyrimidine

Systemtic Name: 4-[4-(diphenylmethyl)piperazin-1-yl]-5-nitro-6-pyrrolidin-1-yl-pyrimidine Openeye Name: 4-(4-benzhydrylpiperazin-1-yl)-5-nitro-6-pyrrolidin-1-yl-pyrimidine CAS Name: 4-[4-(diphenylmethyl)-1-piperazinyl]-5-nitro-6-(1-pyrrolidinyl)pyrimidine IUPAC Name: 4-(4-benzhydrylpiperazin-1-yl)-5-nitro-6-pyrrolidin-1-ylpyrimidine Traditional Name: 4-(4-benzhydrylpiperazino)-5-nitro-6-pyrrolidino-pyrimidine Formula: C25H28N6O2 MolecularWeight: 444.52882

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)C2=C(C(=NC=N2)N3CCN(CC3)C(C4=CC=CC=C4)C5=CC=CC=C5)[N+](=O)[O-]

Isomeric SMILES

C1CCN(C1)C2=C(C(=NC=N2)N3CCN(CC3)C(C4=CC=CC=C4)C5=CC=CC=C5)[N+](=O)[O-]

InChI

InChI=1S/C25H28N6O2/c32-31(33)23-24(29-13-7-8-14-29)26-19-27-25(23)30-17-15-28(16-18-30)22(20-9-3-1-4-10-20)21-11-5-2-6-12-21/h1-6,9-12,19,22H,7-8,13-18H2