methyl 2-[(3-bromanyl-2,6-dimethyl-phenyl)-[2-(2-methylbutanoylsulfanyl)ethanoyl]amino]ethanoate

Systemtic Name: methyl 2-[(3-bromanyl-2,6-dimethyl-phenyl)-[2-(2-methylbutanoylsulfanyl)ethanoyl]amino]ethanoate Openeye Name: methyl 2-(3-bromo-2,6-dimethyl-N-[2-(2-methylbutanoylsulfanyl)acetyl]anilino)acetate CAS Name: 2-(3-bromo-2,6-dimethyl-N-[2-[(2-methyl-1-oxobutyl)thio]-1-oxoethyl]anilino)acetic acid methyl ester IUPAC Name: methyl 2-(3-bromo-2,6-dimethyl-N-[2-(2-methylbutanoylsulfanyl)acetyl]anilino)acetate Traditional Name: 2-(3-bromo-2,6-dimethyl-N-[2-(2-methylbutanoylthio)acetyl]anilino)acetic acid methyl ester Formula: C18H24BrNO4S MolecularWeight: 430.35646

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C(=O)SCC(=O)N(CC(=O)OC)C1=C(C=CC(=C1C)Br)C

Isomeric SMILES

CCC(C)C(=O)SCC(=O)N(CC(=O)OC)C1=C(C=CC(=C1C)Br)C

InChI

InChI=1S/C18H24BrNO4S/c1-6-11(2)18(23)25-10-15(21)20(9-16(22)24-5)17-12(3)7-8-14(19)13(17)4/h7-8,11H,6,9-10H2,1-5H3