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

Systemtic Name: N-[4-(cyanomethyl)phenyl]-2-[(4-methylphenyl)-(4-methylsulfanylphenyl)sulfonyl-amino]ethanamide Openeye Name: N-[4-(cyanomethyl)phenyl]-2-(4-methyl-N-(4-methylsulfanylphenyl)sulfonyl-anilino)acetamide CAS Name: N-[4-(cyanomethyl)phenyl]-2-(4-methyl-N-[4-(methylthio)phenyl]sulfonylanilino)acetamide IUPAC Name: N-[4-(cyanomethyl)phenyl]-2-(4-methyl-N-(4-methylsulfanylphenyl)sulfonylanilino)acetamide Traditional Name: N-[4-(cyanomethyl)phenyl]-2-(4-methyl-N-[4-(methylthio)phenyl]sulfonyl-anilino)acetamide Formula: C24H23N3O3S2 MolecularWeight: 465.58772

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)N(CC(=O)NC2=CC=C(C=C2)CC#N)S(=O)(=O)C3=CC=C(C=C3)SC

Isomeric SMILES

CC1=CC=C(C=C1)N(CC(=O)NC2=CC=C(C=C2)CC#N)S(=O)(=O)C3=CC=C(C=C3)SC

InChI

InChI=1S/C24H23N3O3S2/c1-18-3-9-21(10-4-18)27(32(29,30)23-13-11-22(31-2)12-14-23)17-24(28)26-20-7-5-19(6-8-20)15-16-25/h3-14H,15,17H2,1-2H3,(H,26,28)