N'-(4-bromanyl-3-methyl-phenyl)-N-[2-[4-(4-nitrophenyl)sulfonylpiperazin-1-yl]ethyl]ethanediamide

Systemtic Name: N'-(4-bromanyl-3-methyl-phenyl)-N-[2-[4-(4-nitrophenyl)sulfonylpiperazin-1-yl]ethyl]ethanediamide Openeye Name: N'-(4-bromo-3-methyl-phenyl)-N-[2-[4-(4-nitrophenyl)sulfonylpiperazin-1-yl]ethyl]oxamide CAS Name: N'-(4-bromo-3-methylphenyl)-N-[2-[4-(4-nitrophenyl)sulfonyl-1-piperazinyl]ethyl]oxamide IUPAC Name: N'-(4-bromo-3-methylphenyl)-N-[2-[4-(4-nitrophenyl)sulfonylpiperazin-1-yl]ethyl]oxamide Traditional Name: N'-(4-bromo-3-methyl-phenyl)-N-[2-(4-nosylpiperazino)ethyl]oxamide Formula: C21H24BrN5O6S MolecularWeight: 554.41416

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)NC(=O)C(=O)NCCN2CCN(CC2)S(=O)(=O)C3=CC=C(C=C3)[N+](=O)[O-])Br

Isomeric SMILES

CC1=C(C=CC(=C1)NC(=O)C(=O)NCCN2CCN(CC2)S(=O)(=O)C3=CC=C(C=C3)[N+](=O)[O-])Br

InChI

InChI=1S/C21H24BrN5O6S/c1-15-14-16(2-7-19(15)22)24-21(29)20(28)23-8-9-25-10-12-26(13-11-25)34(32,33)18-5-3-17(4-6-18)27(30)31/h2-7,14H,8-13H2,1H3,(H,23,28)(H,24,29)