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

Systemtic Name: N-[2-(3-iodanylpiperazin-1-yl)-2-(4-phenylphenyl)ethyl]propane-2-sulfonamide Openeye Name: N-[2-(3-iodopiperazin-1-yl)-2-(4-phenylphenyl)ethyl]propane-2-sulfonamide CAS Name: N-[2-(3-iodo-1-piperazinyl)-2-(4-phenylphenyl)ethyl]-2-propanesulfonamide IUPAC Name: N-[2-(3-iodopiperazin-1-yl)-2-(4-phenylphenyl)ethyl]propane-2-sulfonamide Traditional Name: N-[2-(3-iodopiperazino)-2-(4-phenylphenyl)ethyl]propane-2-sulfonamide Formula: C21H28IN3O2S MolecularWeight: 513.43539

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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)I

Isomeric SMILES

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

InChI

InChI=1S/C21H28IN3O2S/c1-16(2)28(26,27)24-14-20(25-13-12-23-21(22)15-25)19-10-8-18(9-11-19)17-6-4-3-5-7-17/h3-11,16,20-21,23-24H,12-15H2,1-2H3