ethyl 2-bromanyl-7-[(2-methoxyphenyl)methyl]-3-methyl-4-oxidanylidene-thieno[2,3-b]pyridine-5-carboxylate

Systemtic Name: ethyl 2-bromanyl-7-[(2-methoxyphenyl)methyl]-3-methyl-4-oxidanylidene-thieno[2,3-b]pyridine-5-carboxylate Openeye Name: ethyl 2-bromo-7-[(2-methoxyphenyl)methyl]-3-methyl-4-oxo-thieno[2,3-b]pyridine-5-carboxylate CAS Name: 2-bromo-7-[(2-methoxyphenyl)methyl]-3-methyl-4-oxo-5-thieno[2,3-b]pyridinecarboxylic acid ethyl ester IUPAC Name: ethyl 2-bromo-7-[(2-methoxyphenyl)methyl]-3-methyl-4-oxothieno[2,3-b]pyridine-5-carboxylate Traditional Name: 2-bromo-4-keto-3-methyl-7-o-anisyl-thieno[2,3-b]pyridine-5-carboxylic acid ethyl ester Formula: C19H18BrNO4S MolecularWeight: 436.31952

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CN(C2=C(C1=O)C(=C(S2)Br)C)CC3=CC=CC=C3OC

Isomeric SMILES

CCOC(=O)C1=CN(C2=C(C1=O)C(=C(S2)Br)C)CC3=CC=CC=C3OC

InChI

InChI=1S/C19H18BrNO4S/c1-4-25-19(23)13-10-21(9-12-7-5-6-8-14(12)24-3)18-15(16(13)22)11(2)17(20)26-18/h5-8,10H,4,9H2,1-3H3