(2-bromanyl-4-cyano-6-ethoxy-phenyl) 2-[methyl(thiophen-2-ylsulfonyl)amino]ethanoate

Systemtic Name: (2-bromanyl-4-cyano-6-ethoxy-phenyl) 2-[methyl(thiophen-2-ylsulfonyl)amino]ethanoate Openeye Name: (2-bromo-4-cyano-6-ethoxy-phenyl) 2-[methyl(2-thienylsulfonyl)amino]acetate CAS Name: 2-[methyl(thiophen-2-ylsulfonyl)amino]acetic acid (2-bromo-4-cyano-6-ethoxyphenyl) ester IUPAC Name: (2-bromo-4-cyano-6-ethoxyphenyl) 2-[methyl(thiophen-2-ylsulfonyl)amino]acetate Traditional Name: 2-[methyl(2-thienylsulfonyl)amino]acetic acid (2-bromo-4-cyano-6-ethoxy-phenyl) ester Formula: C16H15BrN2O5S2 MolecularWeight: 459.3347

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C(=CC(=C1)C#N)Br)OC(=O)CN(C)S(=O)(=O)C2=CC=CS2

Isomeric SMILES

CCOC1=C(C(=CC(=C1)C#N)Br)OC(=O)CN(C)S(=O)(=O)C2=CC=CS2

InChI

InChI=1S/C16H15BrN2O5S2/c1-3-23-13-8-11(9-18)7-12(17)16(13)24-14(20)10-19(2)26(21,22)15-5-4-6-25-15/h4-8H,3,10H2,1-2H3