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

Systemtic Name: 3-azanyl-2-[(4-bromophenyl)carbamoyl]-6-oxidanylidene-7H-thieno[2,3-b]pyridine-5-carboxylate Openeye Name: 3-amino-2-[(4-bromophenyl)carbamoyl]-6-oxo-7H-thieno[2,3-b]pyridine-5-carboxylate CAS Name: 3-amino-2-[(4-bromoanilino)-oxomethyl]-6-oxo-7H-thieno[2,3-b]pyridine-5-carboxylate IUPAC Name: 3-amino-2-[(4-bromophenyl)carbamoyl]-6-oxo-7H-thieno[2,3-b]pyridine-5-carboxylate Traditional Name: 3-amino-2-[(4-bromophenyl)carbamoyl]-6-keto-7H-thieno[2,3-b]pyridine-5-carboxylate Formula: C15H9BrN3O4S- MolecularWeight: 407.21866

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1NC(=O)C2=C(C3=C(S2)NC(=O)C(=C3)C(=O)[O-])N)Br

Isomeric SMILES

C1=CC(=CC=C1NC(=O)C2=C(C3=C(S2)NC(=O)C(=C3)C(=O)[O-])N)Br

InChI

InChI=1S/C15H10BrN3O4S/c16-6-1-3-7(4-2-6)18-13(21)11-10(17)8-5-9(15(22)23)12(20)19-14(8)24-11/h1-5H,17H2,(H,18,21)(H,19,20)(H,22,23)/p-1