methyl 2-[2-(2-methylpropanoylsulfanyl)ethanoyl-(2,3,6-trimethylphenyl)amino]ethanoate

Systemtic Name: methyl 2-[2-(2-methylpropanoylsulfanyl)ethanoyl-(2,3,6-trimethylphenyl)amino]ethanoate Openeye Name: methyl 2-(2,3,6-trimethyl-N-[2-(2-methylpropanoylsulfanyl)acetyl]anilino)acetate CAS Name: 2-(2,3,6-trimethyl-N-[2-[(2-methyl-1-oxopropyl)thio]-1-oxoethyl]anilino)acetic acid methyl ester IUPAC Name: methyl 2-(2,3,6-trimethyl-N-[2-(2-methylpropanoylsulfanyl)acetyl]anilino)acetate Traditional Name: 2-(N-[2-(isobutyrylthio)acetyl]-2,3,6-trimethyl-anilino)acetic acid methyl ester Formula: C18H25NO4S MolecularWeight: 351.4604

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H25NO4S/c1-11(2)18(22)24-10-15(20)19(9-16(21)23-6)17-13(4)8-7-12(3)14(17)5/h7-8,11H,9-10H2,1-6H3