methyl 4-(4-bromophenyl)-5-methyl-2-[2-(5-methyl-2-propan-2-yl-phenoxy)ethanoylamino]thiophene-3-carboxylate

Systemtic Name: methyl 4-(4-bromophenyl)-5-methyl-2-[2-(5-methyl-2-propan-2-yl-phenoxy)ethanoylamino]thiophene-3-carboxylate Openeye Name: methyl 4-(4-bromophenyl)-2-[[2-(2-isopropyl-5-methyl-phenoxy)acetyl]amino]-5-methyl-thiophene-3-carboxylate CAS Name: 4-(4-bromophenyl)-5-methyl-2-[[2-(5-methyl-2-propan-2-ylphenoxy)-1-oxoethyl]amino]-3-thiophenecarboxylic acid methyl ester IUPAC Name: methyl 4-(4-bromophenyl)-5-methyl-2-[[2-(5-methyl-2-propan-2-ylphenoxy)acetyl]amino]thiophene-3-carboxylate Traditional Name: 4-(4-bromophenyl)-2-[[2-(2-isopropyl-5-methyl-phenoxy)acetyl]amino]-5-methyl-thiophene-3-carboxylic acid methyl ester Formula: C25H26BrNO4S MolecularWeight: 516.44724

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C(C)C)OCC(=O)NC2=C(C(=C(S2)C)C3=CC=C(C=C3)Br)C(=O)OC

Isomeric SMILES

CC1=CC(=C(C=C1)C(C)C)OCC(=O)NC2=C(C(=C(S2)C)C3=CC=C(C=C3)Br)C(=O)OC

InChI

InChI=1S/C25H26BrNO4S/c1-14(2)19-11-6-15(3)12-20(19)31-13-21(28)27-24-23(25(29)30-5)22(16(4)32-24)17-7-9-18(26)10-8-17/h6-12,14H,13H2,1-5H3,(H,27,28)