2-[(3-cyano-5-oxidanyl-7-oxidanylidene-4H-thieno[3,2-b]pyridin-2-yl)sulfanyl]-N-(4-dimethylaminophenyl)ethanamide

Systemtic Name: 2-[(3-cyano-5-oxidanyl-7-oxidanylidene-4H-thieno[3,2-b]pyridin-2-yl)sulfanyl]-N-(4-dimethylaminophenyl)ethanamide Openeye Name: 2-[(3-cyano-5-hydroxy-7-oxo-4H-thieno[3,2-b]pyridin-2-yl)sulfanyl]-N-(4-dimethylaminophenyl)acetamide CAS Name: 2-[(3-cyano-5-hydroxy-7-oxo-4H-thieno[3,2-b]pyridin-2-yl)thio]-N-(4-dimethylaminophenyl)acetamide IUPAC Name: 2-[(3-cyano-5-hydroxy-7-oxo-4H-thieno[3,2-b]pyridin-2-yl)sulfanyl]-N-(4-dimethylaminophenyl)acetamide Traditional Name: 2-[(3-cyano-5-hydroxy-7-keto-4H-thieno[3,2-b]pyridin-2-yl)thio]-N-(4-dimethylaminophenyl)acetamide Formula: C18H16N4O3S2 MolecularWeight: 400.47464

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C1=CC=C(C=C1)NC(=O)CSC2=C(C3=C(S2)C(=O)C=C(N3)O)C#N

Isomeric SMILES

CN(C)C1=CC=C(C=C1)NC(=O)CSC2=C(C3=C(S2)C(=O)C=C(N3)O)C#N

InChI

InChI=1S/C18H16N4O3S2/c1-22(2)11-5-3-10(4-6-11)20-15(25)9-26-18-12(8-19)16-17(27-18)13(23)7-14(24)21-16/h3-7H,9H2,1-2H3,(H,20,25)(H2,21,23,24)