N'-(4-methylphenyl)-N-[2-[4-(4-nitrophenyl)sulfonylpiperazin-1-yl]ethyl]ethanediamide

Systemtic Name: N'-(4-methylphenyl)-N-[2-[4-(4-nitrophenyl)sulfonylpiperazin-1-yl]ethyl]ethanediamide Openeye Name: N-[2-[4-(4-nitrophenyl)sulfonylpiperazin-1-yl]ethyl]-N'-(p-tolyl)oxamide CAS Name: N'-(4-methylphenyl)-N-[2-[4-(4-nitrophenyl)sulfonyl-1-piperazinyl]ethyl]oxamide IUPAC Name: N'-(4-methylphenyl)-N-[2-[4-(4-nitrophenyl)sulfonylpiperazin-1-yl]ethyl]oxamide Traditional Name: N-[2-(4-nosylpiperazino)ethyl]-N'-(p-tolyl)oxamide Formula: C21H25N5O6S MolecularWeight: 475.5181

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H25N5O6S/c1-16-2-4-17(5-3-16)23-21(28)20(27)22-10-11-24-12-14-25(15-13-24)33(31,32)19-8-6-18(7-9-19)26(29)30/h2-9H,10-15H2,1H3,(H,22,27)(H,23,28)