2-(2-morpholin-4-ium-4-ylethylsulfanyl)-5-oxidanyl-7-oxidanylidene-4H-thieno[3,2-b]pyridine-3-carbonitrile

Systemtic Name: 2-(2-morpholin-4-ium-4-ylethylsulfanyl)-5-oxidanyl-7-oxidanylidene-4H-thieno[3,2-b]pyridine-3-carbonitrile Openeye Name: 5-hydroxy-2-(2-morpholin-4-ium-4-ylethylsulfanyl)-7-oxo-4H-thieno[3,2-b]pyridine-3-carbonitrile CAS Name: 5-hydroxy-2-[2-(4-morpholin-4-iumyl)ethylthio]-7-oxo-4H-thieno[3,2-b]pyridine-3-carbonitrile IUPAC Name: 5-hydroxy-2-(2-morpholin-4-ium-4-ylethylsulfanyl)-7-oxo-4H-thieno[3,2-b]pyridine-3-carbonitrile Traditional Name: 5-hydroxy-7-keto-2-(2-morpholin-4-ium-4-ylethylthio)-4H-thieno[3,2-b]pyridine-3-carbonitrile Formula: C14H16N3O3S2+ MolecularWeight: 338.42514

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Descriptors Computed from Structure

Canonical SMILES:

C1COCC[NH+]1CCSC2=C(C3=C(S2)C(=O)C=C(N3)O)C#N

Isomeric SMILES

C1COCC[NH+]1CCSC2=C(C3=C(S2)C(=O)C=C(N3)O)C#N

InChI

InChI=1S/C14H15N3O3S2/c15-8-9-12-13(10(18)7-11(19)16-12)22-14(9)21-6-3-17-1-4-20-5-2-17/h7H,1-6H2,(H2,16,18,19)/p+1