4-[4-(2,3-dimethylphenyl)piperazin-1-yl]-6-[4-(diphenylmethyl)piperazin-1-yl]-5-nitro-pyrimidine

Systemtic Name: 4-[4-(2,3-dimethylphenyl)piperazin-1-yl]-6-[4-(diphenylmethyl)piperazin-1-yl]-5-nitro-pyrimidine Openeye Name: 4-(4-benzhydrylpiperazin-1-yl)-6-[4-(2,3-dimethylphenyl)piperazin-1-yl]-5-nitro-pyrimidine CAS Name: 4-[4-(2,3-dimethylphenyl)-1-piperazinyl]-6-[4-(diphenylmethyl)-1-piperazinyl]-5-nitropyrimidine IUPAC Name: 4-(4-benzhydrylpiperazin-1-yl)-6-[4-(2,3-dimethylphenyl)piperazin-1-yl]-5-nitropyrimidine Traditional Name: 4-(4-benzhydrylpiperazino)-6-[4-(2,3-dimethylphenyl)piperazino]-5-nitro-pyrimidine Formula: C33H37N7O2 MolecularWeight: 563.69258

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)N2CCN(CC2)C3=C(C(=NC=N3)N4CCN(CC4)C(C5=CC=CC=C5)C6=CC=CC=C6)[N+](=O)[O-])C

Isomeric SMILES

CC1=C(C(=CC=C1)N2CCN(CC2)C3=C(C(=NC=N3)N4CCN(CC4)C(C5=CC=CC=C5)C6=CC=CC=C6)[N+](=O)[O-])C

InChI

InChI=1S/C33H37N7O2/c1-25-10-9-15-29(26(25)2)36-16-20-38(21-17-36)32-31(40(41)42)33(35-24-34-32)39-22-18-37(19-23-39)30(27-11-5-3-6-12-27)28-13-7-4-8-14-28/h3-15,24,30H,16-23H2,1-2H3