methyl 5-[2-[2,4-bis(bromanyl)-6-methyl-phenoxy]ethanoylamino]-4-cyano-3-methyl-thiophene-2-carboxylate

Systemtic Name: methyl 5-[2-[2,4-bis(bromanyl)-6-methyl-phenoxy]ethanoylamino]-4-cyano-3-methyl-thiophene-2-carboxylate Openeye Name: methyl 4-cyano-5-[[2-(2,4-dibromo-6-methyl-phenoxy)acetyl]amino]-3-methyl-thiophene-2-carboxylate CAS Name: 4-cyano-5-[[2-(2,4-dibromo-6-methylphenoxy)-1-oxoethyl]amino]-3-methyl-2-thiophenecarboxylic acid methyl ester IUPAC Name: methyl 4-cyano-5-[[2-(2,4-dibromo-6-methylphenoxy)acetyl]amino]-3-methylthiophene-2-carboxylate Traditional Name: 4-cyano-5-[[2-(2,4-dibromo-6-methyl-phenoxy)acetyl]amino]-3-methyl-thiophene-2-carboxylic acid methyl ester Formula: C17H14Br2N2O4S MolecularWeight: 502.17706

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1OCC(=O)NC2=C(C(=C(S2)C(=O)OC)C)C#N)Br)Br

Isomeric SMILES

CC1=CC(=CC(=C1OCC(=O)NC2=C(C(=C(S2)C(=O)OC)C)C#N)Br)Br

InChI

InChI=1S/C17H14Br2N2O4S/c1-8-4-10(18)5-12(19)14(8)25-7-13(22)21-16-11(6-20)9(2)15(26-16)17(23)24-3/h4-5H,7H2,1-3H3,(H,21,22)