N-[[1-chloranyl-4-ethyl-6-(2-methylphenyl)-5-phenyl-piperazin-2-yl]methyl]propane-1-sulfonamide

Systemtic Name: N-[[1-chloranyl-4-ethyl-6-(2-methylphenyl)-5-phenyl-piperazin-2-yl]methyl]propane-1-sulfonamide Openeye Name: N-[[1-chloro-4-ethyl-6-(o-tolyl)-5-phenyl-piperazin-2-yl]methyl]propane-1-sulfonamide CAS Name: N-[[1-chloro-4-ethyl-6-(2-methylphenyl)-5-phenyl-2-piperazinyl]methyl]-1-propanesulfonamide IUPAC Name: N-[[1-chloro-4-ethyl-6-(2-methylphenyl)-5-phenylpiperazin-2-yl]methyl]propane-1-sulfonamide Traditional Name: N-[[1-chloro-4-ethyl-6-(o-tolyl)-5-phenyl-piperazin-2-yl]methyl]propane-1-sulfonamide Formula: C23H32ClN3O2S MolecularWeight: 450.03708

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCS(=O)(=O)NCC1CN(C(C(N1Cl)C2=CC=CC=C2C)C3=CC=CC=C3)CC

Isomeric SMILES

CCCS(=O)(=O)NCC1CN(C(C(N1Cl)C2=CC=CC=C2C)C3=CC=CC=C3)CC

InChI

InChI=1S/C23H32ClN3O2S/c1-4-15-30(28,29)25-16-20-17-26(5-2)22(19-12-7-6-8-13-19)23(27(20)24)21-14-10-9-11-18(21)3/h6-14,20,22-23,25H,4-5,15-17H2,1-3H3