3-azanyl-2-[(4-butylphenyl)carbamoyl]-6-oxidanylidene-7H-thieno[2,3-b]pyridine-5-carboxylic acid

Systemtic Name: 3-azanyl-2-[(4-butylphenyl)carbamoyl]-6-oxidanylidene-7H-thieno[2,3-b]pyridine-5-carboxylic acid Openeye Name: 3-amino-2-[(4-butylphenyl)carbamoyl]-6-oxo-7H-thieno[2,3-b]pyridine-5-carboxylic acid CAS Name: 3-amino-2-[(4-butylanilino)-oxomethyl]-6-oxo-7H-thieno[2,3-b]pyridine-5-carboxylic acid IUPAC Name: 3-amino-2-[(4-butylphenyl)carbamoyl]-6-oxo-7H-thieno[2,3-b]pyridine-5-carboxylic acid Traditional Name: 3-amino-2-[(4-butylphenyl)carbamoyl]-6-keto-7H-thieno[2,3-b]pyridine-5-carboxylic acid Formula: C19H19N3O4S MolecularWeight: 385.43686

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CC=C(C=C1)NC(=O)C2=C(C3=C(S2)NC(=O)C(=C3)C(=O)O)N

Isomeric SMILES

CCCCC1=CC=C(C=C1)NC(=O)C2=C(C3=C(S2)NC(=O)C(=C3)C(=O)O)N

InChI

InChI=1S/C19H19N3O4S/c1-2-3-4-10-5-7-11(8-6-10)21-17(24)15-14(20)12-9-13(19(25)26)16(23)22-18(12)27-15/h5-9H,2-4,20H2,1H3,(H,21,24)(H,22,23)(H,25,26)