2-[4-(2-methyl-5-nitro-phenyl)sulfonylpiperazin-1-yl]-N-phenethyl-ethanamide

Systemtic Name: 2-[4-(2-methyl-5-nitro-phenyl)sulfonylpiperazin-1-yl]-N-phenethyl-ethanamide Openeye Name: 2-[4-(2-methyl-5-nitro-phenyl)sulfonylpiperazin-1-yl]-N-phenethyl-acetamide CAS Name: 2-[4-(2-methyl-5-nitrophenyl)sulfonyl-1-piperazinyl]-N-phenethylacetamide IUPAC Name: 2-[4-(2-methyl-5-nitrophenyl)sulfonylpiperazin-1-yl]-N-phenethylacetamide Traditional Name: 2-[4-(2-methyl-5-nitro-phenyl)sulfonylpiperazino]-N-phenethyl-acetamide Formula: C21H26N4O5S MolecularWeight: 446.51994

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)[N+](=O)[O-])S(=O)(=O)N2CCN(CC2)CC(=O)NCCC3=CC=CC=C3

Isomeric SMILES

CC1=C(C=C(C=C1)[N+](=O)[O-])S(=O)(=O)N2CCN(CC2)CC(=O)NCCC3=CC=CC=C3

InChI

InChI=1S/C21H26N4O5S/c1-17-7-8-19(25(27)28)15-20(17)31(29,30)24-13-11-23(12-14-24)16-21(26)22-10-9-18-5-3-2-4-6-18/h2-8,15H,9-14,16H2,1H3,(H,22,26)