N-[2-[3-(phenylmethyl)piperazin-1-yl]-4-propyl-phenyl]sulfamoyl iodide

Systemtic Name: N-[2-[3-(phenylmethyl)piperazin-1-yl]-4-propyl-phenyl]sulfamoyl iodide Openeye Name: N-[2-(3-benzylpiperazin-1-yl)-4-propyl-phenyl]sulfamoyl iodide CAS Name: N-[2-[3-(phenylmethyl)-1-piperazinyl]-4-propylphenyl]sulfamoyl iodide IUPAC Name: N-[2-(3-benzylpiperazin-1-yl)-4-propylphenyl]sulfamoyl iodide Traditional Name: N-[2-(3-benzylpiperazino)-4-propyl-phenyl]sulfamoyl iodide Formula: C20H26IN3O2S MolecularWeight: 499.40881

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=CC(=C(C=C1)NS(=O)(=O)I)N2CCNC(C2)CC3=CC=CC=C3

Isomeric SMILES

CCCC1=CC(=C(C=C1)NS(=O)(=O)I)N2CCNC(C2)CC3=CC=CC=C3

InChI

InChI=1S/C20H26IN3O2S/c1-2-6-16-9-10-19(23-27(21,25)26)20(14-16)24-12-11-22-18(15-24)13-17-7-4-3-5-8-17/h3-5,7-10,14,18,22-23H,2,6,11-13,15H2,1H3