(5-azanyl-4-cyano-2-ethoxycarbonyl-thiophen-3-yl)methyl 5-bromanylfuran-2-carboxylate

Systemtic Name: (5-azanyl-4-cyano-2-ethoxycarbonyl-thiophen-3-yl)methyl 5-bromanylfuran-2-carboxylate Openeye Name: (5-amino-4-cyano-2-ethoxycarbonyl-3-thienyl)methyl 5-bromofuran-2-carboxylate CAS Name: 5-bromo-2-furancarboxylic acid (5-amino-4-cyano-2-ethoxycarbonyl-3-thiophenyl)methyl ester IUPAC Name: (5-amino-4-cyano-2-ethoxycarbonylthiophen-3-yl)methyl 5-bromofuran-2-carboxylate Traditional Name: 5-bromofuran-2-carboxylic acid (5-amino-2-carbethoxy-4-cyano-3-thienyl)methyl ester Formula: C14H11BrN2O5S MolecularWeight: 399.21654

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C(=C(S1)N)C#N)COC(=O)C2=CC=C(O2)Br

Isomeric SMILES

CCOC(=O)C1=C(C(=C(S1)N)C#N)COC(=O)C2=CC=C(O2)Br

InChI

InChI=1S/C14H11BrN2O5S/c1-2-20-14(19)11-8(7(5-16)12(17)23-11)6-21-13(18)9-3-4-10(15)22-9/h3-4H,2,6,17H2,1H3