1-[4-[4-[bis(4-fluorophenyl)methyl]piperazin-1-yl]-3-nitro-phenyl]sulfonyl-4-methyl-piperazine

Systemtic Name: 1-[4-[4-[bis(4-fluorophenyl)methyl]piperazin-1-yl]-3-nitro-phenyl]sulfonyl-4-methyl-piperazine Openeye Name: 1-[4-[4-[bis(4-fluorophenyl)methyl]piperazin-1-yl]-3-nitro-phenyl]sulfonyl-4-methyl-piperazine CAS Name: 1-[4-[4-[bis(4-fluorophenyl)methyl]-1-piperazinyl]-3-nitrophenyl]sulfonyl-4-methylpiperazine IUPAC Name: 1-[4-[4-[bis(4-fluorophenyl)methyl]piperazin-1-yl]-3-nitrophenyl]sulfonyl-4-methylpiperazine Traditional Name: 1-[4-[4-[bis(4-fluorophenyl)methyl]piperazino]-3-nitro-phenyl]sulfonyl-4-methyl-piperazine Formula: C28H31F2N5O4S MolecularWeight: 571.638646

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCN(CC1)S(=O)(=O)C2=CC(=C(C=C2)N3CCN(CC3)C(C4=CC=C(C=C4)F)C5=CC=C(C=C5)F)[N+](=O)[O-]

Isomeric SMILES

CN1CCN(CC1)S(=O)(=O)C2=CC(=C(C=C2)N3CCN(CC3)C(C4=CC=C(C=C4)F)C5=CC=C(C=C5)F)[N+](=O)[O-]

InChI

InChI=1S/C28H31F2N5O4S/c1-31-12-18-34(19-13-31)40(38,39)25-10-11-26(27(20-25)35(36)37)32-14-16-33(17-15-32)28(21-2-6-23(29)7-3-21)22-4-8-24(30)9-5-22/h2-11,20,28H,12-19H2,1H3