(2-thiophen-2-yl-1,3-oxazol-4-yl)methyl 4-bromanyl-1H-pyrrole-2-carboxylate

Systemtic Name: (2-thiophen-2-yl-1,3-oxazol-4-yl)methyl 4-bromanyl-1H-pyrrole-2-carboxylate Openeye Name: [2-(2-thienyl)oxazol-4-yl]methyl 4-bromo-1H-pyrrole-2-carboxylate CAS Name: 4-bromo-1H-pyrrole-2-carboxylic acid (2-thiophen-2-yl-4-oxazolyl)methyl ester IUPAC Name: (2-thiophen-2-yl-1,3-oxazol-4-yl)methyl 4-bromo-1H-pyrrole-2-carboxylate Traditional Name: 4-bromo-1H-pyrrole-2-carboxylic acid [2-(2-thienyl)oxazol-4-yl]methyl ester Formula: C13H9BrN2O3S MolecularWeight: 353.19116

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Descriptors Computed from Structure

Canonical SMILES:

C1=CSC(=C1)C2=NC(=CO2)COC(=O)C3=CC(=CN3)Br

Isomeric SMILES

C1=CSC(=C1)C2=NC(=CO2)COC(=O)C3=CC(=CN3)Br

InChI

InChI=1S/C13H9BrN2O3S/c14-8-4-10(15-5-8)13(17)19-7-9-6-18-12(16-9)11-2-1-3-20-11/h1-6,15H,7H2