3-[4-(6-chloranylhexanoyl)piperazin-1-yl]-4-methoxy-N-methyl-N-phenethyl-benzenesulfonamide

Systemtic Name: 3-[4-(6-chloranylhexanoyl)piperazin-1-yl]-4-methoxy-N-methyl-N-phenethyl-benzenesulfonamide Openeye Name: 3-[4-(6-chlorohexanoyl)piperazin-1-yl]-4-methoxy-N-methyl-N-phenethyl-benzenesulfonamide CAS Name: 3-[4-(6-chloro-1-oxohexyl)-1-piperazinyl]-4-methoxy-N-methyl-N-phenethylbenzenesulfonamide IUPAC Name: 3-[4-(6-chlorohexanoyl)piperazin-1-yl]-4-methoxy-N-methyl-N-phenethylbenzenesulfonamide Traditional Name: 3-[4-(6-chlorohexanoyl)piperazino]-4-methoxy-N-methyl-N-phenethyl-benzenesulfonamide Formula: C26H36ClN3O4S MolecularWeight: 522.09974

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Descriptors Computed from Structure

Canonical SMILES:

CN(CCC1=CC=CC=C1)S(=O)(=O)C2=CC(=C(C=C2)OC)N3CCN(CC3)C(=O)CCCCCCl

Isomeric SMILES

CN(CCC1=CC=CC=C1)S(=O)(=O)C2=CC(=C(C=C2)OC)N3CCN(CC3)C(=O)CCCCCCl

InChI

InChI=1S/C26H36ClN3O4S/c1-28(16-14-22-9-5-3-6-10-22)35(32,33)23-12-13-25(34-2)24(21-23)29-17-19-30(20-18-29)26(31)11-7-4-8-15-27/h3,5-6,9-10,12-13,21H,4,7-8,11,14-20H2,1-2H3