propan-2-yl 2-[2-(4-bromanylphenoxy)ethanoylamino]-4-(4-cyclohexylphenyl)thiophene-3-carboxylate

Systemtic Name: propan-2-yl 2-[2-(4-bromanylphenoxy)ethanoylamino]-4-(4-cyclohexylphenyl)thiophene-3-carboxylate Openeye Name: isopropyl 2-[[2-(4-bromophenoxy)acetyl]amino]-4-(4-cyclohexylphenyl)thiophene-3-carboxylate CAS Name: 2-[[2-(4-bromophenoxy)-1-oxoethyl]amino]-4-(4-cyclohexylphenyl)-3-thiophenecarboxylic acid propan-2-yl ester IUPAC Name: propan-2-yl 2-[[2-(4-bromophenoxy)acetyl]amino]-4-(4-cyclohexylphenyl)thiophene-3-carboxylate Traditional Name: 2-[[2-(4-bromophenoxy)acetyl]amino]-4-(4-cyclohexylphenyl)thiophene-3-carboxylic acid isopropyl ester Formula: C28H30BrNO4S MolecularWeight: 556.5111

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)OC(=O)C1=C(SC=C1C2=CC=C(C=C2)C3CCCCC3)NC(=O)COC4=CC=C(C=C4)Br

Isomeric SMILES

CC(C)OC(=O)C1=C(SC=C1C2=CC=C(C=C2)C3CCCCC3)NC(=O)COC4=CC=C(C=C4)Br

InChI

InChI=1S/C28H30BrNO4S/c1-18(2)34-28(32)26-24(21-10-8-20(9-11-21)19-6-4-3-5-7-19)17-35-27(26)30-25(31)16-33-23-14-12-22(29)13-15-23/h8-15,17-19H,3-7,16H2,1-2H3,(H,30,31)