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

Systemtic Name: methyl 2-[(3-bromanyl-2,6-dimethyl-phenyl)-[2-(furan-2-ylcarbonylsulfanyl)ethanoyl]amino]ethanoate Openeye Name: methyl 2-(3-bromo-N-[2-(furan-2-carbonylsulfanyl)acetyl]-2,6-dimethyl-anilino)acetate CAS Name: 2-(3-bromo-N-[2-[[2-furanyl(oxo)methyl]thio]-1-oxoethyl]-2,6-dimethylanilino)acetic acid methyl ester IUPAC Name: methyl 2-(3-bromo-N-[2-(furan-2-carbonylsulfanyl)acetyl]-2,6-dimethylanilino)acetate Traditional Name: 2-(3-bromo-N-[2-(2-furoylthio)acetyl]-2,6-dimethyl-anilino)acetic acid methyl ester Formula: C18H18BrNO5S MolecularWeight: 440.30822

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=C(C=C1)Br)C)N(CC(=O)OC)C(=O)CSC(=O)C2=CC=CO2

Isomeric SMILES

CC1=C(C(=C(C=C1)Br)C)N(CC(=O)OC)C(=O)CSC(=O)C2=CC=CO2

InChI

InChI=1S/C18H18BrNO5S/c1-11-6-7-13(19)12(2)17(11)20(9-16(22)24-3)15(21)10-26-18(23)14-5-4-8-25-14/h4-8H,9-10H2,1-3H3