4-[2-[4-(azepan-1-ylsulfonyl)piperazin-1-yl]ethoxy]benzenesulfonamide

Systemtic Name: 4-[2-[4-(azepan-1-ylsulfonyl)piperazin-1-yl]ethoxy]benzenesulfonamide Openeye Name: 4-[2-[4-(azepan-1-ylsulfonyl)piperazin-1-yl]ethoxy]benzenesulfonamide CAS Name: 4-[2-[4-(1-azepanylsulfonyl)-1-piperazinyl]ethoxy]benzenesulfonamide IUPAC Name: 4-[2-[4-(azepan-1-ylsulfonyl)piperazin-1-yl]ethoxy]benzenesulfonamide Traditional Name: 4-[2-[4-(azepan-1-ylsulfonyl)piperazino]ethoxy]benzenesulfonamide Formula: C18H30N4O5S2 MolecularWeight: 446.5846

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)S(=O)(=O)N2CCN(CC2)CCOC3=CC=C(C=C3)S(=O)(=O)N

Isomeric SMILES

C1CCCN(CC1)S(=O)(=O)N2CCN(CC2)CCOC3=CC=C(C=C3)S(=O)(=O)N

InChI

InChI=1S/C18H30N4O5S2/c19-28(23,24)18-7-5-17(6-8-18)27-16-15-20-11-13-22(14-12-20)29(25,26)21-9-3-1-2-4-10-21/h5-8H,1-4,9-16H2,(H2,19,23,24)