ethyl 5-azanyl-3-[(5-bromanylthiophen-2-yl)carbonyloxymethyl]-4-cyano-thiophene-2-carboxylate

Systemtic Name: ethyl 5-azanyl-3-[(5-bromanylthiophen-2-yl)carbonyloxymethyl]-4-cyano-thiophene-2-carboxylate Openeye Name: ethyl 5-amino-3-[(5-bromothiophene-2-carbonyl)oxymethyl]-4-cyano-thiophene-2-carboxylate CAS Name: 5-amino-3-[[(5-bromo-2-thiophenyl)-oxomethoxy]methyl]-4-cyano-2-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 5-amino-3-[(5-bromothiophene-2-carbonyl)oxymethyl]-4-cyanothiophene-2-carboxylate Traditional Name: 5-amino-3-[(5-bromothiophene-2-carbonyl)oxymethyl]-4-cyano-thiophene-2-carboxylic acid ethyl ester Formula: C14H11BrN2O4S2 MolecularWeight: 415.28214

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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(S2)Br

Isomeric SMILES

CCOC(=O)C1=C(C(=C(S1)N)C#N)COC(=O)C2=CC=C(S2)Br

InChI

InChI=1S/C14H11BrN2O4S2/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