2-[(4-iodophenyl)-methylsulfonyl-amino]-N-[1-(4-methoxyphenyl)-3-methyl-butyl]ethanamide

Systemtic Name: 2-[(4-iodophenyl)-methylsulfonyl-amino]-N-[1-(4-methoxyphenyl)-3-methyl-butyl]ethanamide Openeye Name: 2-(4-iodo-N-methylsulfonyl-anilino)-N-[1-(4-methoxyphenyl)-3-methyl-butyl]acetamide CAS Name: 2-(4-iodo-N-methylsulfonylanilino)-N-[1-(4-methoxyphenyl)-3-methylbutyl]acetamide IUPAC Name: 2-(4-iodo-N-methylsulfonylanilino)-N-[1-(4-methoxyphenyl)-3-methylbutyl]acetamide Traditional Name: 2-(4-iodo-N-mesyl-anilino)-N-[1-(4-methoxyphenyl)-3-methyl-butyl]acetamide Formula: C21H27IN2O4S MolecularWeight: 530.41955

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(C1=CC=C(C=C1)OC)NC(=O)CN(C2=CC=C(C=C2)I)S(=O)(=O)C

Isomeric SMILES

CC(C)CC(C1=CC=C(C=C1)OC)NC(=O)CN(C2=CC=C(C=C2)I)S(=O)(=O)C

InChI

InChI=1S/C21H27IN2O4S/c1-15(2)13-20(16-5-11-19(28-3)12-6-16)23-21(25)14-24(29(4,26)27)18-9-7-17(22)8-10-18/h5-12,15,20H,13-14H2,1-4H3,(H,23,25)