N-[2-(3-oxidanylpiperazin-1-yl)-2-(4-propylphenyl)ethyl]benzenesulfonamide

Systemtic Name: N-[2-(3-oxidanylpiperazin-1-yl)-2-(4-propylphenyl)ethyl]benzenesulfonamide Openeye Name: N-[2-(3-hydroxypiperazin-1-yl)-2-(4-propylphenyl)ethyl]benzenesulfonamide CAS Name: N-[2-(3-hydroxy-1-piperazinyl)-2-(4-propylphenyl)ethyl]benzenesulfonamide IUPAC Name: N-[2-(3-hydroxypiperazin-1-yl)-2-(4-propylphenyl)ethyl]benzenesulfonamide Traditional Name: N-[2-(3-hydroxypiperazino)-2-(4-propylphenyl)ethyl]benzenesulfonamide Formula: C21H29N3O3S MolecularWeight: 403.53826

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=CC=C(C=C1)C(CNS(=O)(=O)C2=CC=CC=C2)N3CCNC(C3)O

Isomeric SMILES

CCCC1=CC=C(C=C1)C(CNS(=O)(=O)C2=CC=CC=C2)N3CCNC(C3)O

InChI

InChI=1S/C21H29N3O3S/c1-2-6-17-9-11-18(12-10-17)20(24-14-13-22-21(25)16-24)15-23-28(26,27)19-7-4-3-5-8-19/h3-5,7-12,20-23,25H,2,6,13-16H2,1H3