ethyl 2-[2-(4-bromanyl-2-propan-2-yl-phenoxy)ethanoylamino]-4-(3,4-dimethoxyphenyl)thiophene-3-carboxylate

Systemtic Name: ethyl 2-[2-(4-bromanyl-2-propan-2-yl-phenoxy)ethanoylamino]-4-(3,4-dimethoxyphenyl)thiophene-3-carboxylate Openeye Name: ethyl 2-[[2-(4-bromo-2-isopropyl-phenoxy)acetyl]amino]-4-(3,4-dimethoxyphenyl)thiophene-3-carboxylate CAS Name: 2-[[2-(4-bromo-2-propan-2-ylphenoxy)-1-oxoethyl]amino]-4-(3,4-dimethoxyphenyl)-3-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 2-[[2-(4-bromo-2-propan-2-ylphenoxy)acetyl]amino]-4-(3,4-dimethoxyphenyl)thiophene-3-carboxylate Traditional Name: 2-[[2-(4-bromo-2-isopropyl-phenoxy)acetyl]amino]-4-(3,4-dimethoxyphenyl)thiophene-3-carboxylic acid ethyl ester Formula: C26H28BrNO6S MolecularWeight: 562.47262

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(SC=C1C2=CC(=C(C=C2)OC)OC)NC(=O)COC3=C(C=C(C=C3)Br)C(C)C

Isomeric SMILES

CCOC(=O)C1=C(SC=C1C2=CC(=C(C=C2)OC)OC)NC(=O)COC3=C(C=C(C=C3)Br)C(C)C

InChI

InChI=1S/C26H28BrNO6S/c1-6-33-26(30)24-19(16-7-9-21(31-4)22(11-16)32-5)14-35-25(24)28-23(29)13-34-20-10-8-17(27)12-18(20)15(2)3/h7-12,14-15H,6,13H2,1-5H3,(H,28,29)