methyl 4-(4-bromophenyl)-5-methyl-2-(propanoylamino)thiophene-3-carboxylate

Systemtic Name: methyl 4-(4-bromophenyl)-5-methyl-2-(propanoylamino)thiophene-3-carboxylate Openeye Name: methyl 4-(4-bromophenyl)-5-methyl-2-(propanoylamino)thiophene-3-carboxylate CAS Name: 4-(4-bromophenyl)-5-methyl-2-(1-oxopropylamino)-3-thiophenecarboxylic acid methyl ester IUPAC Name: methyl 4-(4-bromophenyl)-5-methyl-2-(propanoylamino)thiophene-3-carboxylate Traditional Name: 4-(4-bromophenyl)-5-methyl-2-propionamido-thiophene-3-carboxylic acid methyl ester Formula: C16H16BrNO3S MolecularWeight: 382.27214

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)NC1=C(C(=C(S1)C)C2=CC=C(C=C2)Br)C(=O)OC

Isomeric SMILES

CCC(=O)NC1=C(C(=C(S1)C)C2=CC=C(C=C2)Br)C(=O)OC

InChI

InChI=1S/C16H16BrNO3S/c1-4-12(19)18-15-14(16(20)21-3)13(9(2)22-15)10-5-7-11(17)8-6-10/h5-8H,4H2,1-3H3,(H,18,19)