2-[(4-methylphenyl)-(4-methylsulfanylphenyl)sulfonyl-amino]-N-(2-methylpropyl)ethanamide

Systemtic Name: 2-[(4-methylphenyl)-(4-methylsulfanylphenyl)sulfonyl-amino]-N-(2-methylpropyl)ethanamide Openeye Name: N-isobutyl-2-(4-methyl-N-(4-methylsulfanylphenyl)sulfonyl-anilino)acetamide CAS Name: 2-(4-methyl-N-[4-(methylthio)phenyl]sulfonylanilino)-N-(2-methylpropyl)acetamide IUPAC Name: 2-(4-methyl-N-(4-methylsulfanylphenyl)sulfonylanilino)-N-(2-methylpropyl)acetamide Traditional Name: N-isobutyl-2-(4-methyl-N-[4-(methylthio)phenyl]sulfonyl-anilino)acetamide Formula: C20H26N2O3S2 MolecularWeight: 406.56204

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)N(CC(=O)NCC(C)C)S(=O)(=O)C2=CC=C(C=C2)SC

Isomeric SMILES

CC1=CC=C(C=C1)N(CC(=O)NCC(C)C)S(=O)(=O)C2=CC=C(C=C2)SC

InChI

InChI=1S/C20H26N2O3S2/c1-15(2)13-21-20(23)14-22(17-7-5-16(3)6-8-17)27(24,25)19-11-9-18(26-4)10-12-19/h5-12,15H,13-14H2,1-4H3,(H,21,23)