ethyl 4-(4-bromophenyl)-2-(2-methylpropanoylamino)thiophene-3-carboxylate

Systemtic Name: ethyl 4-(4-bromophenyl)-2-(2-methylpropanoylamino)thiophene-3-carboxylate Openeye Name: ethyl 4-(4-bromophenyl)-2-(2-methylpropanoylamino)thiophene-3-carboxylate CAS Name: 4-(4-bromophenyl)-2-[(2-methyl-1-oxopropyl)amino]-3-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 4-(4-bromophenyl)-2-(2-methylpropanoylamino)thiophene-3-carboxylate Traditional Name: 4-(4-bromophenyl)-2-(isobutyrylamino)thiophene-3-carboxylic acid ethyl ester Formula: C17H18BrNO3S MolecularWeight: 396.29872

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H18BrNO3S/c1-4-22-17(21)14-13(11-5-7-12(18)8-6-11)9-23-16(14)19-15(20)10(2)3/h5-10H,4H2,1-3H3,(H,19,20)