ethyl 2-[2-(3-bromanylphenoxy)propanoylamino]-5-phenyl-thiophene-3-carboxylate

Systemtic Name: ethyl 2-[2-(3-bromanylphenoxy)propanoylamino]-5-phenyl-thiophene-3-carboxylate Openeye Name: ethyl 2-[2-(3-bromophenoxy)propanoylamino]-5-phenyl-thiophene-3-carboxylate CAS Name: 2-[[2-(3-bromophenoxy)-1-oxopropyl]amino]-5-phenyl-3-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 2-[2-(3-bromophenoxy)propanoylamino]-5-phenylthiophene-3-carboxylate Traditional Name: 2-[2-(3-bromophenoxy)propanoylamino]-5-phenyl-thiophene-3-carboxylic acid ethyl ester Formula: C22H20BrNO4S MolecularWeight: 474.3675

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(SC(=C1)C2=CC=CC=C2)NC(=O)C(C)OC3=CC(=CC=C3)Br

Isomeric SMILES

CCOC(=O)C1=C(SC(=C1)C2=CC=CC=C2)NC(=O)C(C)OC3=CC(=CC=C3)Br

InChI

InChI=1S/C22H20BrNO4S/c1-3-27-22(26)18-13-19(15-8-5-4-6-9-15)29-21(18)24-20(25)14(2)28-17-11-7-10-16(23)12-17/h4-14H,3H2,1-2H3,(H,24,25)