ethyl 2-[(6-bromanyl-2-oxidanylidene-chromen-3-yl)carbonylamino]-4-(3,4-dimethylphenyl)thiophene-3-carboxylate

Systemtic Name: ethyl 2-[(6-bromanyl-2-oxidanylidene-chromen-3-yl)carbonylamino]-4-(3,4-dimethylphenyl)thiophene-3-carboxylate Openeye Name: ethyl 2-[(6-bromo-2-oxo-chromene-3-carbonyl)amino]-4-(3,4-dimethylphenyl)thiophene-3-carboxylate CAS Name: 2-[[(6-bromo-2-oxo-1-benzopyran-3-yl)-oxomethyl]amino]-4-(3,4-dimethylphenyl)-3-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 2-[(6-bromo-2-oxochromene-3-carbonyl)amino]-4-(3,4-dimethylphenyl)thiophene-3-carboxylate Traditional Name: 2-[(6-bromo-2-keto-chromene-3-carbonyl)amino]-4-(3,4-dimethylphenyl)thiophene-3-carboxylic acid ethyl ester Formula: C25H20BrNO5S MolecularWeight: 526.399

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(SC=C1C2=CC(=C(C=C2)C)C)NC(=O)C3=CC4=C(C=CC(=C4)Br)OC3=O

Isomeric SMILES

CCOC(=O)C1=C(SC=C1C2=CC(=C(C=C2)C)C)NC(=O)C3=CC4=C(C=CC(=C4)Br)OC3=O

InChI

InChI=1S/C25H20BrNO5S/c1-4-31-25(30)21-19(15-6-5-13(2)14(3)9-15)12-33-23(21)27-22(28)18-11-16-10-17(26)7-8-20(16)32-24(18)29/h5-12H,4H2,1-3H3,(H,27,28)