3-azanyl-2-[(3,5-dimethylphenyl)carbamoyl]-6-oxidanylidene-7H-thieno[2,3-b]pyridine-5-carboxylic acid

Systemtic Name: 3-azanyl-2-[(3,5-dimethylphenyl)carbamoyl]-6-oxidanylidene-7H-thieno[2,3-b]pyridine-5-carboxylic acid Openeye Name: 3-amino-2-[(3,5-dimethylphenyl)carbamoyl]-6-oxo-7H-thieno[2,3-b]pyridine-5-carboxylic acid CAS Name: 3-amino-2-[(3,5-dimethylanilino)-oxomethyl]-6-oxo-7H-thieno[2,3-b]pyridine-5-carboxylic acid IUPAC Name: 3-amino-2-[(3,5-dimethylphenyl)carbamoyl]-6-oxo-7H-thieno[2,3-b]pyridine-5-carboxylic acid Traditional Name: 3-amino-2-[(3,5-dimethylphenyl)carbamoyl]-6-keto-7H-thieno[2,3-b]pyridine-5-carboxylic acid Formula: C17H15N3O4S MolecularWeight: 357.3837

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1)NC(=O)C2=C(C3=C(S2)NC(=O)C(=C3)C(=O)O)N)C

Isomeric SMILES

CC1=CC(=CC(=C1)NC(=O)C2=C(C3=C(S2)NC(=O)C(=C3)C(=O)O)N)C

InChI

InChI=1S/C17H15N3O4S/c1-7-3-8(2)5-9(4-7)19-15(22)13-12(18)10-6-11(17(23)24)14(21)20-16(10)25-13/h3-6H,18H2,1-2H3,(H,19,22)(H,20,21)(H,23,24)