O4-ethyl O2-propan-2-yl 5-[2-(2-bromanyl-4-propyl-phenoxy)ethanoylamino]-3-methyl-thiophene-2,4-dicarboxylate

Systemtic Name: O4-ethyl O2-propan-2-yl 5-[2-(2-bromanyl-4-propyl-phenoxy)ethanoylamino]-3-methyl-thiophene-2,4-dicarboxylate Openeye Name: O4-ethyl O2-isopropyl 5-[[2-(2-bromo-4-propyl-phenoxy)acetyl]amino]-3-methyl-thiophene-2,4-dicarboxylate CAS Name: 5-[[2-(2-bromo-4-propylphenoxy)-1-oxoethyl]amino]-3-methylthiophene-2,4-dicarboxylic acid O4-ethyl ester O2-propan-2-yl ester IUPAC Name: 4-O-ethyl 2-O-propan-2-yl 5-[[2-(2-bromo-4-propylphenoxy)acetyl]amino]-3-methylthiophene-2,4-dicarboxylate Traditional Name: 5-[[2-(2-bromo-4-propyl-phenoxy)acetyl]amino]-3-methyl-thiophene-2,4-dicarboxylic acid O4-ethyl ester O2-isopropyl ester Formula: C23H28BrNO6S MolecularWeight: 526.44052

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=CC(=C(C=C1)OCC(=O)NC2=C(C(=C(S2)C(=O)OC(C)C)C)C(=O)OCC)Br

Isomeric SMILES

CCCC1=CC(=C(C=C1)OCC(=O)NC2=C(C(=C(S2)C(=O)OC(C)C)C)C(=O)OCC)Br

InChI

InChI=1S/C23H28BrNO6S/c1-6-8-15-9-10-17(16(24)11-15)30-12-18(26)25-21-19(22(27)29-7-2)14(5)20(32-21)23(28)31-13(3)4/h9-11,13H,6-8,12H2,1-5H3,(H,25,26)