N-methyl-4-[4-(2-nitrophenyl)piperazin-1-yl]carbonyl-N-propan-2-yl-benzenesulfonamide

Systemtic Name: N-methyl-4-[4-(2-nitrophenyl)piperazin-1-yl]carbonyl-N-propan-2-yl-benzenesulfonamide Openeye Name: N-isopropyl-N-methyl-4-[4-(2-nitrophenyl)piperazine-1-carbonyl]benzenesulfonamide CAS Name: N-methyl-4-[[4-(2-nitrophenyl)-1-piperazinyl]-oxomethyl]-N-propan-2-ylbenzenesulfonamide IUPAC Name: N-methyl-4-[4-(2-nitrophenyl)piperazine-1-carbonyl]-N-propan-2-ylbenzenesulfonamide Traditional Name: N-isopropyl-N-methyl-4-[4-(2-nitrophenyl)piperazine-1-carbonyl]benzenesulfonamide Formula: C21H26N4O5S MolecularWeight: 446.51994

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H26N4O5S/c1-16(2)22(3)31(29,30)18-10-8-17(9-11-18)21(26)24-14-12-23(13-15-24)19-6-4-5-7-20(19)25(27)28/h4-11,16H,12-15H2,1-3H3