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

Systemtic Name: methyl 5-[(5-bromanyl-2-methoxy-3-methyl-phenyl)carbonylamino]-4-cyano-3-methyl-thiophene-2-carboxylate Openeye Name: methyl 5-[(5-bromo-2-methoxy-3-methyl-benzoyl)amino]-4-cyano-3-methyl-thiophene-2-carboxylate CAS Name: 5-[[(5-bromo-2-methoxy-3-methylphenyl)-oxomethyl]amino]-4-cyano-3-methyl-2-thiophenecarboxylic acid methyl ester IUPAC Name: methyl 5-[(5-bromo-2-methoxy-3-methylbenzoyl)amino]-4-cyano-3-methylthiophene-2-carboxylate Traditional Name: 5-[(5-bromo-2-methoxy-3-methyl-benzoyl)amino]-4-cyano-3-methyl-thiophene-2-carboxylic acid methyl ester Formula: C17H15BrN2O4S MolecularWeight: 423.281

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC(=C1)Br)C(=O)NC2=C(C(=C(S2)C(=O)OC)C)C#N)OC

Isomeric SMILES

CC1=C(C(=CC(=C1)Br)C(=O)NC2=C(C(=C(S2)C(=O)OC)C)C#N)OC

InChI

InChI=1S/C17H15BrN2O4S/c1-8-5-10(18)6-11(13(8)23-3)15(21)20-16-12(7-19)9(2)14(25-16)17(22)24-4/h5-6H,1-4H3,(H,20,21)