2-[(4-iodophenyl)-methylsulfonyl-amino]-N-(3-pyrrolidin-1-ylpropyl)ethanamide

Systemtic Name: 2-[(4-iodophenyl)-methylsulfonyl-amino]-N-(3-pyrrolidin-1-ylpropyl)ethanamide Openeye Name: 2-(4-iodo-N-methylsulfonyl-anilino)-N-(3-pyrrolidin-1-ylpropyl)acetamide CAS Name: 2-(4-iodo-N-methylsulfonylanilino)-N-[3-(1-pyrrolidinyl)propyl]acetamide IUPAC Name: 2-(4-iodo-N-methylsulfonylanilino)-N-(3-pyrrolidin-1-ylpropyl)acetamide Traditional Name: 2-(4-iodo-N-mesyl-anilino)-N-(3-pyrrolidinopropyl)acetamide Formula: C16H24IN3O3S MolecularWeight: 465.34953

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)N(CC(=O)NCCCN1CCCC1)C2=CC=C(C=C2)I

Isomeric SMILES

CS(=O)(=O)N(CC(=O)NCCCN1CCCC1)C2=CC=C(C=C2)I

InChI

InChI=1S/C16H24IN3O3S/c1-24(22,23)20(15-7-5-14(17)6-8-15)13-16(21)18-9-4-12-19-10-2-3-11-19/h5-8H,2-4,9-13H2,1H3,(H,18,21)