2-[2-(4-acetamidophenyl)sulfanylethanoyl-methyl-amino]-N-(2,6-dimethylphenyl)ethanamide

Systemtic Name: 2-[2-(4-acetamidophenyl)sulfanylethanoyl-methyl-amino]-N-(2,6-dimethylphenyl)ethanamide Openeye Name: 2-[[2-(4-acetamidophenyl)sulfanylacetyl]-methyl-amino]-N-(2,6-dimethylphenyl)acetamide CAS Name: 2-[[2-[(4-acetamidophenyl)thio]-1-oxoethyl]-methylamino]-N-(2,6-dimethylphenyl)acetamide IUPAC Name: 2-[[2-(4-acetamidophenyl)sulfanylacetyl]-methylamino]-N-(2,6-dimethylphenyl)acetamide Traditional Name: 2-[[2-[(4-acetamidophenyl)thio]acetyl]-methyl-amino]-N-(2,6-dimethylphenyl)acetamide Formula: C21H25N3O3S MolecularWeight: 399.5065

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)C)NC(=O)CN(C)C(=O)CSC2=CC=C(C=C2)NC(=O)C

Isomeric SMILES

CC1=C(C(=CC=C1)C)NC(=O)CN(C)C(=O)CSC2=CC=C(C=C2)NC(=O)C

InChI

InChI=1S/C21H25N3O3S/c1-14-6-5-7-15(2)21(14)23-19(26)12-24(4)20(27)13-28-18-10-8-17(9-11-18)22-16(3)25/h5-11H,12-13H2,1-4H3,(H,22,25)(H,23,26)