2-[(4-methylphenyl)sulfonyl-phenethyl-amino]-N-[1-(4-methylsulfanylphenyl)ethyl]ethanamide

Systemtic Name: 2-[(4-methylphenyl)sulfonyl-phenethyl-amino]-N-[1-(4-methylsulfanylphenyl)ethyl]ethanamide Openeye Name: N-[1-(4-methylsulfanylphenyl)ethyl]-2-[phenethyl(p-tolylsulfonyl)amino]acetamide CAS Name: 2-[(4-methylphenyl)sulfonyl-phenethylamino]-N-[1-[4-(methylthio)phenyl]ethyl]acetamide IUPAC Name: 2-[(4-methylphenyl)sulfonyl-phenethylamino]-N-[1-(4-methylsulfanylphenyl)ethyl]acetamide Traditional Name: N-[1-[4-(methylthio)phenyl]ethyl]-2-[phenethyl(tosyl)amino]acetamide Formula: C26H30N2O3S2 MolecularWeight: 482.658

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)N(CCC2=CC=CC=C2)CC(=O)NC(C)C3=CC=C(C=C3)SC

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N(CCC2=CC=CC=C2)CC(=O)NC(C)C3=CC=C(C=C3)SC

InChI

InChI=1S/C26H30N2O3S2/c1-20-9-15-25(16-10-20)33(30,31)28(18-17-22-7-5-4-6-8-22)19-26(29)27-21(2)23-11-13-24(32-3)14-12-23/h4-16,21H,17-19H2,1-3H3,(H,27,29)