N-[4-(phenylmethyl)-2-(3-propan-2-ylsulfonylpiperazin-1-yl)phenyl]sulfamoyl iodide

Systemtic Name: N-[4-(phenylmethyl)-2-(3-propan-2-ylsulfonylpiperazin-1-yl)phenyl]sulfamoyl iodide Openeye Name: N-[4-benzyl-2-(3-isopropylsulfonylpiperazin-1-yl)phenyl]sulfamoyl iodide CAS Name: N-[4-(phenylmethyl)-2-(3-propan-2-ylsulfonyl-1-piperazinyl)phenyl]sulfamoyl iodide IUPAC Name: N-[4-benzyl-2-(3-propan-2-ylsulfonylpiperazin-1-yl)phenyl]sulfamoyl iodide Traditional Name: N-[4-benzyl-2-(3-isopropylsulfonylpiperazino)phenyl]sulfamoyl iodide Formula: C20H26IN3O4S2 MolecularWeight: 563.47261

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)S(=O)(=O)C1CN(CCN1)C2=C(C=CC(=C2)CC3=CC=CC=C3)NS(=O)(=O)I

Isomeric SMILES

CC(C)S(=O)(=O)C1CN(CCN1)C2=C(C=CC(=C2)CC3=CC=CC=C3)NS(=O)(=O)I

InChI

InChI=1S/C20H26IN3O4S2/c1-15(2)29(25,26)20-14-24(11-10-22-20)19-13-17(12-16-6-4-3-5-7-16)8-9-18(19)23-30(21,27)28/h3-9,13,15,20,22-23H,10-12,14H2,1-2H3