2,5-bis(chloranyl)-N-[4-(4-octanoylpiperazin-1-yl)phenyl]benzenesulfonamide

Systemtic Name: 2,5-bis(chloranyl)-N-[4-(4-octanoylpiperazin-1-yl)phenyl]benzenesulfonamide Openeye Name: 2,5-dichloro-N-[4-(4-octanoylpiperazin-1-yl)phenyl]benzenesulfonamide CAS Name: 2,5-dichloro-N-[4-[4-(1-oxooctyl)-1-piperazinyl]phenyl]benzenesulfonamide IUPAC Name: 2,5-dichloro-N-[4-(4-octanoylpiperazin-1-yl)phenyl]benzenesulfonamide Traditional Name: N-[4-(4-caprylylpiperazino)phenyl]-2,5-dichloro-benzenesulfonamide Formula: C24H31Cl2N3O3S MolecularWeight: 512.49224

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCC(=O)N1CCN(CC1)C2=CC=C(C=C2)NS(=O)(=O)C3=C(C=CC(=C3)Cl)Cl

Isomeric SMILES

CCCCCCCC(=O)N1CCN(CC1)C2=CC=C(C=C2)NS(=O)(=O)C3=C(C=CC(=C3)Cl)Cl

InChI

InChI=1S/C24H31Cl2N3O3S/c1-2-3-4-5-6-7-24(30)29-16-14-28(15-17-29)21-11-9-20(10-12-21)27-33(31,32)23-18-19(25)8-13-22(23)26/h8-13,18,27H,2-7,14-17H2,1H3