ethyl 5-[(5-bromanylthiophen-2-yl)carbonylamino]-4-cyano-3-methyl-thiophene-2-carboxylate

Systemtic Name: ethyl 5-[(5-bromanylthiophen-2-yl)carbonylamino]-4-cyano-3-methyl-thiophene-2-carboxylate Openeye Name: ethyl 5-[(5-bromothiophene-2-carbonyl)amino]-4-cyano-3-methyl-thiophene-2-carboxylate CAS Name: 5-[[(5-bromo-2-thiophenyl)-oxomethyl]amino]-4-cyano-3-methyl-2-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 5-[(5-bromothiophene-2-carbonyl)amino]-4-cyano-3-methylthiophene-2-carboxylate Traditional Name: 5-[(5-bromothiophene-2-carbonyl)amino]-4-cyano-3-methyl-thiophene-2-carboxylic acid ethyl ester Formula: C14H11BrN2O3S2 MolecularWeight: 399.28274

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H11BrN2O3S2/c1-3-20-14(19)11-7(2)8(6-16)13(22-11)17-12(18)9-4-5-10(15)21-9/h4-5H,3H2,1-2H3,(H,17,18)