ethyl 3-azanyl-2-(4-bromophenyl)carbonyl-6-oxidanylidene-7H-thieno[2,3-b]pyridine-5-carboxylate

Systemtic Name: ethyl 3-azanyl-2-(4-bromophenyl)carbonyl-6-oxidanylidene-7H-thieno[2,3-b]pyridine-5-carboxylate Openeye Name: ethyl 3-amino-2-(4-bromobenzoyl)-6-oxo-7H-thieno[2,3-b]pyridine-5-carboxylate CAS Name: 3-amino-2-[(4-bromophenyl)-oxomethyl]-6-oxo-7H-thieno[2,3-b]pyridine-5-carboxylic acid ethyl ester IUPAC Name: ethyl 3-amino-2-(4-bromobenzoyl)-6-oxo-7H-thieno[2,3-b]pyridine-5-carboxylate Traditional Name: 3-amino-2-(4-bromobenzoyl)-6-keto-7H-thieno[2,3-b]pyridine-5-carboxylic acid ethyl ester Formula: C17H13BrN2O4S MolecularWeight: 421.26512

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC2=C(NC1=O)SC(=C2N)C(=O)C3=CC=C(C=C3)Br

Isomeric SMILES

CCOC(=O)C1=CC2=C(NC1=O)SC(=C2N)C(=O)C3=CC=C(C=C3)Br

InChI

InChI=1S/C17H13BrN2O4S/c1-2-24-17(23)11-7-10-12(19)14(25-16(10)20-15(11)22)13(21)8-3-5-9(18)6-4-8/h3-7H,2,19H2,1H3,(H,20,22)