3-chloranyl-1-[2-(phenylsulfonylsulfonylamino)-5-propan-2-ylsulfonyl-phenyl]piperazine

Systemtic Name: 3-chloranyl-1-[2-(phenylsulfonylsulfonylamino)-5-propan-2-ylsulfonyl-phenyl]piperazine Openeye Name: 1-[2-(benzenesulfonylsulfonylamino)-5-isopropylsulfonyl-phenyl]-3-chloro-piperazine CAS Name: 1-[2-(benzenesulfonylsulfonylamino)-5-propan-2-ylsulfonylphenyl]-3-chloropiperazine IUPAC Name: 1-[2-(benzenesulfonylsulfonylamino)-5-propan-2-ylsulfonylphenyl]-3-chloropiperazine Traditional Name: 1-[2-(besylsulfonylamino)-5-isopropylsulfonyl-phenyl]-3-chloro-piperazine Formula: C19H24ClN3O6S3 MolecularWeight: 522.05836

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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