N-[2-(3-oxidanylpiperazin-1-yl)-2-(4-phenylphenyl)ethyl]propane-2-sulfonamide

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

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)S(=O)(=O)NCC(C1=CC=C(C=C1)C2=CC=CC=C2)N3CCNC(C3)O

Isomeric SMILES

CC(C)S(=O)(=O)NCC(C1=CC=C(C=C1)C2=CC=CC=C2)N3CCNC(C3)O

InChI

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