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

Systemtic Name: ethyl 4-(4-bromophenyl)-2-(2-ethylbutanoylamino)thiophene-3-carboxylate Openeye Name: ethyl 4-(4-bromophenyl)-2-(2-ethylbutanoylamino)thiophene-3-carboxylate CAS Name: 4-(4-bromophenyl)-2-[(2-ethyl-1-oxobutyl)amino]-3-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 4-(4-bromophenyl)-2-(2-ethylbutanoylamino)thiophene-3-carboxylate Traditional Name: 4-(4-bromophenyl)-2-(2-ethylbutanoylamino)thiophene-3-carboxylic acid ethyl ester Formula: C19H22BrNO3S MolecularWeight: 424.35188

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CC)C(=O)NC1=C(C(=CS1)C2=CC=C(C=C2)Br)C(=O)OCC

Isomeric SMILES

CCC(CC)C(=O)NC1=C(C(=CS1)C2=CC=C(C=C2)Br)C(=O)OCC

InChI

InChI=1S/C19H22BrNO3S/c1-4-12(5-2)17(22)21-18-16(19(23)24-6-3)15(11-25-18)13-7-9-14(20)10-8-13/h7-12H,4-6H2,1-3H3,(H,21,22)