3-chloranyl-1-[5-(phenylsulfonyl)-2-(propan-2-ylsulfonylsulfonylamino)phenyl]piperazine

Systemtic Name: 3-chloranyl-1-[5-(phenylsulfonyl)-2-(propan-2-ylsulfonylsulfonylamino)phenyl]piperazine Openeye Name: 1-[5-(benzenesulfonyl)-2-(isopropylsulfonylsulfonylamino)phenyl]-3-chloro-piperazine CAS Name: 1-[5-(benzenesulfonyl)-2-(propan-2-ylsulfonylsulfonylamino)phenyl]-3-chloropiperazine IUPAC Name: 1-[5-(benzenesulfonyl)-2-(propan-2-ylsulfonylsulfonylamino)phenyl]-3-chloropiperazine Traditional Name: 1-[5-besyl-2-(isopropylsulfonylsulfonylamino)phenyl]-3-chloro-piperazine Formula: C19H24ClN3O6S3 MolecularWeight: 522.05836

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)S(=O)(=O)S(=O)(=O)NC1=C(C=C(C=C1)S(=O)(=O)C2=CC=CC=C2)N3CCNC(C3)Cl

Isomeric SMILES

CC(C)S(=O)(=O)S(=O)(=O)NC1=C(C=C(C=C1)S(=O)(=O)C2=CC=CC=C2)N3CCNC(C3)Cl

InChI

InChI=1S/C19H24ClN3O6S3/c1-14(2)31(26,27)32(28,29)22-17-9-8-16(30(24,25)15-6-4-3-5-7-15)12-18(17)23-11-10-21-19(20)13-23/h3-9,12,14,19,21-22H,10-11,13H2,1-2H3