N-[3-[(2S)-3-[4-(4-methoxyphenyl)sulfonylpiperazin-1-yl]-2-oxidanyl-propoxy]phenyl]benzenesulfonamide

Systemtic Name: N-[3-[(2S)-3-[4-(4-methoxyphenyl)sulfonylpiperazin-1-yl]-2-oxidanyl-propoxy]phenyl]benzenesulfonamide Openeye Name: N-[3-[(2S)-2-hydroxy-3-[4-(4-methoxyphenyl)sulfonylpiperazin-1-yl]propoxy]phenyl]benzenesulfonamide CAS Name: N-[3-[(2S)-2-hydroxy-3-[4-(4-methoxyphenyl)sulfonyl-1-piperazinyl]propoxy]phenyl]benzenesulfonamide IUPAC Name: N-[3-[(2S)-2-hydroxy-3-[4-(4-methoxyphenyl)sulfonylpiperazin-1-yl]propoxy]phenyl]benzenesulfonamide Traditional Name: N-[3-[(2S)-2-hydroxy-3-[4-(4-methoxyphenyl)sulfonylpiperazino]propoxy]phenyl]benzenesulfonamide Formula: C26H31N3O7S2 MolecularWeight: 561.67024

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)S(=O)(=O)N2CCN(CC2)CC(COC3=CC=CC(=C3)NS(=O)(=O)C4=CC=CC=C4)O

Isomeric SMILES

COC1=CC=C(C=C1)S(=O)(=O)N2CCN(CC2)C[C@@H](COC3=CC=CC(=C3)NS(=O)(=O)C4=CC=CC=C4)O

InChI

InChI=1S/C26H31N3O7S2/c1-35-23-10-12-26(13-11-23)38(33,34)29-16-14-28(15-17-29)19-22(30)20-36-24-7-5-6-21(18-24)27-37(31,32)25-8-3-2-4-9-25/h2-13,18,22,27,30H,14-17,19-20H2,1H3/t22-/m0/s1