N-tert-butyl-2-chloranyl-5-[4-(2-methoxyphenyl)piperazin-1-yl]carbonyl-benzenesulfonamide

Systemtic Name: N-tert-butyl-2-chloranyl-5-[4-(2-methoxyphenyl)piperazin-1-yl]carbonyl-benzenesulfonamide Openeye Name: N-tert-butyl-2-chloro-5-[4-(2-methoxyphenyl)piperazine-1-carbonyl]benzenesulfonamide CAS Name: N-tert-butyl-2-chloro-5-[[4-(2-methoxyphenyl)-1-piperazinyl]-oxomethyl]benzenesulfonamide IUPAC Name: N-tert-butyl-2-chloro-5-[4-(2-methoxyphenyl)piperazine-1-carbonyl]benzenesulfonamide Traditional Name: N-tert-butyl-2-chloro-5-[4-(2-methoxyphenyl)piperazine-1-carbonyl]benzenesulfonamide Formula: C22H28ClN3O4S MolecularWeight: 465.99342

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)NS(=O)(=O)C1=C(C=CC(=C1)C(=O)N2CCN(CC2)C3=CC=CC=C3OC)Cl

Isomeric SMILES

CC(C)(C)NS(=O)(=O)C1=C(C=CC(=C1)C(=O)N2CCN(CC2)C3=CC=CC=C3OC)Cl

InChI

InChI=1S/C22H28ClN3O4S/c1-22(2,3)24-31(28,29)20-15-16(9-10-17(20)23)21(27)26-13-11-25(12-14-26)18-7-5-6-8-19(18)30-4/h5-10,15,24H,11-14H2,1-4H3