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

Systemtic Name: 3-azanyl-2-(4-bromophenyl)carbonyl-6-oxidanylidene-7H-thieno[2,3-b]pyridine-5-carboxylate Openeye Name: 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-carboxylate IUPAC Name: 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-carboxylate Formula: C15H8BrN2O4S- MolecularWeight: 392.20402

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C(=O)C2=C(C3=C(S2)NC(=O)C(=C3)C(=O)[O-])N)Br

Isomeric SMILES

C1=CC(=CC=C1C(=O)C2=C(C3=C(S2)NC(=O)C(=C3)C(=O)[O-])N)Br

InChI

InChI=1S/C15H9BrN2O4S/c16-7-3-1-6(2-4-7)11(19)12-10(17)8-5-9(15(21)22)13(20)18-14(8)23-12/h1-5H,17H2,(H,18,20)(H,21,22)/p-1