methyl 5-[(5-bromanyl-2-methoxy-phenyl)carbonylamino]-4-cyano-3-methyl-thiophene-2-carboxylate

Systemtic Name: methyl 5-[(5-bromanyl-2-methoxy-phenyl)carbonylamino]-4-cyano-3-methyl-thiophene-2-carboxylate Openeye Name: methyl 5-[(5-bromo-2-methoxy-benzoyl)amino]-4-cyano-3-methyl-thiophene-2-carboxylate CAS Name: 5-[[(5-bromo-2-methoxyphenyl)-oxomethyl]amino]-4-cyano-3-methyl-2-thiophenecarboxylic acid methyl ester IUPAC Name: methyl 5-[(5-bromo-2-methoxybenzoyl)amino]-4-cyano-3-methylthiophene-2-carboxylate Traditional Name: 5-[(5-bromo-2-methoxy-benzoyl)amino]-4-cyano-3-methyl-thiophene-2-carboxylic acid methyl ester Formula: C16H13BrN2O4S MolecularWeight: 409.25442

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC(=C1C#N)NC(=O)C2=C(C=CC(=C2)Br)OC)C(=O)OC

Isomeric SMILES

CC1=C(SC(=C1C#N)NC(=O)C2=C(C=CC(=C2)Br)OC)C(=O)OC

InChI

InChI=1S/C16H13BrN2O4S/c1-8-11(7-18)15(24-13(8)16(21)23-3)19-14(20)10-6-9(17)4-5-12(10)22-2/h4-6H,1-3H3,(H,19,20)