3-methoxy-1-[5-(2-methylpropyl)-2-(phenylsulfonylsulfonylamino)phenyl]piperazine

Systemtic Name: 3-methoxy-1-[5-(2-methylpropyl)-2-(phenylsulfonylsulfonylamino)phenyl]piperazine Openeye Name: 1-[2-(benzenesulfonylsulfonylamino)-5-isobutyl-phenyl]-3-methoxy-piperazine CAS Name: 1-[2-(benzenesulfonylsulfonylamino)-5-(2-methylpropyl)phenyl]-3-methoxypiperazine IUPAC Name: 1-[2-(benzenesulfonylsulfonylamino)-5-(2-methylpropyl)phenyl]-3-methoxypiperazine Traditional Name: 1-[2-(besylsulfonylamino)-5-isobutyl-phenyl]-3-methoxy-piperazine Formula: C21H29N3O5S2 MolecularWeight: 467.60206

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC1=CC(=C(C=C1)NS(=O)(=O)S(=O)(=O)C2=CC=CC=C2)N3CCNC(C3)OC

Isomeric SMILES

CC(C)CC1=CC(=C(C=C1)NS(=O)(=O)S(=O)(=O)C2=CC=CC=C2)N3CCNC(C3)OC

InChI

InChI=1S/C21H29N3O5S2/c1-16(2)13-17-9-10-19(20(14-17)24-12-11-22-21(15-24)29-3)23-31(27,28)30(25,26)18-7-5-4-6-8-18/h4-10,14,16,21-23H,11-13,15H2,1-3H3