N-[1-(4-tert-butylphenyl)ethyl]-2-[(4-iodophenyl)-methylsulfonyl-amino]ethanamide

Systemtic Name: N-[1-(4-tert-butylphenyl)ethyl]-2-[(4-iodophenyl)-methylsulfonyl-amino]ethanamide Openeye Name: N-[1-(4-tert-butylphenyl)ethyl]-2-(4-iodo-N-methylsulfonyl-anilino)acetamide CAS Name: N-[1-(4-tert-butylphenyl)ethyl]-2-(4-iodo-N-methylsulfonylanilino)acetamide IUPAC Name: N-[1-(4-tert-butylphenyl)ethyl]-2-(4-iodo-N-methylsulfonylanilino)acetamide Traditional Name: N-[1-(4-tert-butylphenyl)ethyl]-2-(4-iodo-N-mesyl-anilino)acetamide Formula: C21H27IN2O3S MolecularWeight: 514.42015

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H27IN2O3S/c1-15(16-6-8-17(9-7-16)21(2,3)4)23-20(25)14-24(28(5,26)27)19-12-10-18(22)11-13-19/h6-13,15H,14H2,1-5H3,(H,23,25)