ethyl 2-benzamido-4-(4-bromophenyl)-5-(dimethylaminomethyl)thiophene-3-carboxylate

Systemtic Name: ethyl 2-benzamido-4-(4-bromophenyl)-5-(dimethylaminomethyl)thiophene-3-carboxylate Openeye Name: ethyl 2-benzamido-4-(4-bromophenyl)-5-(dimethylaminomethyl)thiophene-3-carboxylate CAS Name: 2-benzamido-4-(4-bromophenyl)-5-(dimethylaminomethyl)-3-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 2-benzamido-4-(4-bromophenyl)-5-(dimethylaminomethyl)thiophene-3-carboxylate Traditional Name: 2-benzamido-4-(4-bromophenyl)-5-(dimethylaminomethyl)thiophene-3-carboxylic acid ethyl ester Formula: C23H23BrN2O3S MolecularWeight: 487.40932

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C23H23BrN2O3S/c1-4-29-23(28)20-19(15-10-12-17(24)13-11-15)18(14-26(2)3)30-22(20)25-21(27)16-8-6-5-7-9-16/h5-13H,4,14H2,1-3H3,(H,25,27)