N-[2-(4-ethylphenyl)-2-[3-(2-hydroxyphenyl)piperazin-1-yl]ethyl]propane-2-sulfonamide

Systemtic Name: N-[2-(4-ethylphenyl)-2-[3-(2-hydroxyphenyl)piperazin-1-yl]ethyl]propane-2-sulfonamide Openeye Name: N-[2-(4-ethylphenyl)-2-[3-(2-hydroxyphenyl)piperazin-1-yl]ethyl]propane-2-sulfonamide CAS Name: N-[2-(4-ethylphenyl)-2-[3-(2-hydroxyphenyl)-1-piperazinyl]ethyl]-2-propanesulfonamide IUPAC Name: N-[2-(4-ethylphenyl)-2-[3-(2-hydroxyphenyl)piperazin-1-yl]ethyl]propane-2-sulfonamide Traditional Name: N-[2-(4-ethylphenyl)-2-[3-(2-hydroxyphenyl)piperazino]ethyl]propane-2-sulfonamide Formula: C23H33N3O3S MolecularWeight: 431.59142

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)C(CNS(=O)(=O)C(C)C)N2CCNC(C2)C3=CC=CC=C3O

Isomeric SMILES

CCC1=CC=C(C=C1)C(CNS(=O)(=O)C(C)C)N2CCNC(C2)C3=CC=CC=C3O

InChI

InChI=1S/C23H33N3O3S/c1-4-18-9-11-19(12-10-18)22(15-25-30(28,29)17(2)3)26-14-13-24-21(16-26)20-7-5-6-8-23(20)27/h5-12,17,21-22,24-25,27H,4,13-16H2,1-3H3