methyl 2-[2-(3,3-dimethylbutanoylsulfanyl)ethanoyl-(2,6-dimethylphenyl)amino]ethanoate

Systemtic Name: methyl 2-[2-(3,3-dimethylbutanoylsulfanyl)ethanoyl-(2,6-dimethylphenyl)amino]ethanoate Openeye Name: methyl 2-(N-[2-(3,3-dimethylbutanoylsulfanyl)acetyl]-2,6-dimethyl-anilino)acetate CAS Name: 2-(N-[2-[(3,3-dimethyl-1-oxobutyl)thio]-1-oxoethyl]-2,6-dimethylanilino)acetic acid methyl ester IUPAC Name: methyl 2-(N-[2-(3,3-dimethylbutanoylsulfanyl)acetyl]-2,6-dimethylanilino)acetate Traditional Name: 2-(N-[2-(3,3-dimethylbutanoylthio)acetyl]-2,6-dimethyl-anilino)acetic acid methyl ester Formula: C19H27NO4S MolecularWeight: 365.48698

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)C)N(CC(=O)OC)C(=O)CSC(=O)CC(C)(C)C

Isomeric SMILES

CC1=C(C(=CC=C1)C)N(CC(=O)OC)C(=O)CSC(=O)CC(C)(C)C

InChI

InChI=1S/C19H27NO4S/c1-13-8-7-9-14(2)18(13)20(11-16(22)24-6)15(21)12-25-17(23)10-19(3,4)5/h7-9H,10-12H2,1-6H3