methyl 4-(4-bromophenyl)-3-pyrrol-1-yl-thiophene-2-carboxylate

Systemtic Name: methyl 4-(4-bromophenyl)-3-pyrrol-1-yl-thiophene-2-carboxylate Openeye Name: methyl 4-(4-bromophenyl)-3-pyrrol-1-yl-thiophene-2-carboxylate CAS Name: 4-(4-bromophenyl)-3-(1-pyrrolyl)-2-thiophenecarboxylic acid methyl ester IUPAC Name: methyl 4-(4-bromophenyl)-3-pyrrol-1-ylthiophene-2-carboxylate Traditional Name: 4-(4-bromophenyl)-3-pyrrol-1-yl-thiophene-2-carboxylic acid methyl ester Formula: C16H12BrNO2S MolecularWeight: 362.24098

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=C(C(=CS1)C2=CC=C(C=C2)Br)N3C=CC=C3

Isomeric SMILES

COC(=O)C1=C(C(=CS1)C2=CC=C(C=C2)Br)N3C=CC=C3

InChI

InChI=1S/C16H12BrNO2S/c1-20-16(19)15-14(18-8-2-3-9-18)13(10-21-15)11-4-6-12(17)7-5-11/h2-10H,1H3