N-(2-nitrophenyl)-2-[4-(2,3,5,6-tetramethylphenyl)sulfonylpiperazin-1-yl]ethanamide

Systemtic Name: N-(2-nitrophenyl)-2-[4-(2,3,5,6-tetramethylphenyl)sulfonylpiperazin-1-yl]ethanamide Openeye Name: N-(2-nitrophenyl)-2-[4-(2,3,5,6-tetramethylphenyl)sulfonylpiperazin-1-yl]acetamide CAS Name: N-(2-nitrophenyl)-2-[4-(2,3,5,6-tetramethylphenyl)sulfonyl-1-piperazinyl]acetamide IUPAC Name: N-(2-nitrophenyl)-2-[4-(2,3,5,6-tetramethylphenyl)sulfonylpiperazin-1-yl]acetamide Traditional Name: N-(2-nitrophenyl)-2-[4-(2,3,5,6-tetramethylphenyl)sulfonylpiperazino]acetamide Formula: C22H28N4O5S MolecularWeight: 460.54652

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C(=C1C)S(=O)(=O)N2CCN(CC2)CC(=O)NC3=CC=CC=C3[N+](=O)[O-])C)C

Isomeric SMILES

CC1=CC(=C(C(=C1C)S(=O)(=O)N2CCN(CC2)CC(=O)NC3=CC=CC=C3[N+](=O)[O-])C)C

InChI

InChI=1S/C22H28N4O5S/c1-15-13-16(2)18(4)22(17(15)3)32(30,31)25-11-9-24(10-12-25)14-21(27)23-19-7-5-6-8-20(19)26(28)29/h5-8,13H,9-12,14H2,1-4H3,(H,23,27)