2-[4-(3,4-dimethylphenyl)sulfonylpiperazin-1-yl]-N-(2-iodanylphenyl)ethanamide

Systemtic Name: 2-[4-(3,4-dimethylphenyl)sulfonylpiperazin-1-yl]-N-(2-iodanylphenyl)ethanamide Openeye Name: 2-[4-(3,4-dimethylphenyl)sulfonylpiperazin-1-yl]-N-(2-iodophenyl)acetamide CAS Name: 2-[4-(3,4-dimethylphenyl)sulfonyl-1-piperazinyl]-N-(2-iodophenyl)acetamide IUPAC Name: 2-[4-(3,4-dimethylphenyl)sulfonylpiperazin-1-yl]-N-(2-iodophenyl)acetamide Traditional Name: 2-[4-(3,4-dimethylphenyl)sulfonylpiperazino]-N-(2-iodophenyl)acetamide Formula: C20H24IN3O3S MolecularWeight: 513.39233

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)S(=O)(=O)N2CCN(CC2)CC(=O)NC3=CC=CC=C3I)C

Isomeric SMILES

CC1=C(C=C(C=C1)S(=O)(=O)N2CCN(CC2)CC(=O)NC3=CC=CC=C3I)C

InChI

InChI=1S/C20H24IN3O3S/c1-15-7-8-17(13-16(15)2)28(26,27)24-11-9-23(10-12-24)14-20(25)22-19-6-4-3-5-18(19)21/h3-8,13H,9-12,14H2,1-2H3,(H,22,25)