N-(2-iodanylphenyl)-N-[4-[phenylsulfonyl(4-pyrrolidin-1-ylbut-2-ynyl)amino]but-2-ynyl]ethanamide

Systemtic Name: N-(2-iodanylphenyl)-N-[4-[phenylsulfonyl(4-pyrrolidin-1-ylbut-2-ynyl)amino]but-2-ynyl]ethanamide Openeye Name: N-[4-[benzenesulfonyl(4-pyrrolidin-1-ylbut-2-ynyl)amino]but-2-ynyl]-N-(2-iodophenyl)acetamide CAS Name: N-[4-[benzenesulfonyl-[4-(1-pyrrolidinyl)but-2-ynyl]amino]but-2-ynyl]-N-(2-iodophenyl)acetamide IUPAC Name: N-[4-[benzenesulfonyl(4-pyrrolidin-1-ylbut-2-ynyl)amino]but-2-ynyl]-N-(2-iodophenyl)acetamide Traditional Name: N-[4-[besyl(4-pyrrolidinobut-2-ynyl)amino]but-2-ynyl]-N-(2-iodophenyl)acetamide Formula: C26H28IN3O3S MolecularWeight: 589.48829

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)N(CC#CCN(CC#CCN1CCCC1)S(=O)(=O)C2=CC=CC=C2)C3=CC=CC=C3I

Isomeric SMILES

CC(=O)N(CC#CCN(CC#CCN1CCCC1)S(=O)(=O)C2=CC=CC=C2)C3=CC=CC=C3I

InChI

InChI=1S/C26H28IN3O3S/c1-23(31)30(26-16-6-5-15-25(26)27)22-12-11-21-29(20-10-9-19-28-17-7-8-18-28)34(32,33)24-13-3-2-4-14-24/h2-6,13-16H,7-8,17-22H2,1H3