1-[5-[4-(4-bromophenyl)sulfonylpiperazin-1-yl]-2-nitro-phenyl]-4-methyl-piperazine

Systemtic Name: 1-[5-[4-(4-bromophenyl)sulfonylpiperazin-1-yl]-2-nitro-phenyl]-4-methyl-piperazine Openeye Name: 1-[5-[4-(4-bromophenyl)sulfonylpiperazin-1-yl]-2-nitro-phenyl]-4-methyl-piperazine CAS Name: 1-[5-[4-(4-bromophenyl)sulfonyl-1-piperazinyl]-2-nitrophenyl]-4-methylpiperazine IUPAC Name: 1-[5-[4-(4-bromophenyl)sulfonylpiperazin-1-yl]-2-nitrophenyl]-4-methylpiperazine Traditional Name: 1-[5-(4-brosylpiperazino)-2-nitro-phenyl]-4-methyl-piperazine Formula: C21H26BrN5O4S MolecularWeight: 524.43124

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H26BrN5O4S/c1-23-8-10-25(11-9-23)21-16-18(4-7-20(21)27(28)29)24-12-14-26(15-13-24)32(30,31)19-5-2-17(22)3-6-19/h2-7,16H,8-15H2,1H3