ethyl 2-acetamido-6-bromanyl-7-(2-diethylaminoethyloxy)-1-benzothiophene-3-carboxylate

Systemtic Name: ethyl 2-acetamido-6-bromanyl-7-(2-diethylaminoethyloxy)-1-benzothiophene-3-carboxylate Openeye Name: ethyl 2-acetamido-6-bromo-7-(2-diethylaminoethyloxy)benzothiophene-3-carboxylate CAS Name: 2-acetamido-6-bromo-7-(2-diethylaminoethyloxy)-1-benzothiophene-3-carboxylic acid ethyl ester IUPAC Name: ethyl 2-acetamido-6-bromo-7-(2-diethylaminoethyloxy)-1-benzothiophene-3-carboxylate Traditional Name: 2-acetamido-6-bromo-7-(2-diethylaminoethyloxy)benzothiophene-3-carboxylic acid ethyl ester Formula: C19H25BrN2O4S MolecularWeight: 457.3818

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)CCOC1=C(C=CC2=C1SC(=C2C(=O)OCC)NC(=O)C)Br

Isomeric SMILES

CCN(CC)CCOC1=C(C=CC2=C1SC(=C2C(=O)OCC)NC(=O)C)Br

InChI

InChI=1S/C19H25BrN2O4S/c1-5-22(6-2)10-11-26-16-14(20)9-8-13-15(19(24)25-7-3)18(21-12(4)23)27-17(13)16/h8-9H,5-7,10-11H2,1-4H3,(H,21,23)