3-cyano-2-(2-morpholin-4-ylethylsulfanyl)-7-oxidanylidene-4H-thieno[3,2-b]pyridin-5-olate

Systemtic Name: 3-cyano-2-(2-morpholin-4-ylethylsulfanyl)-7-oxidanylidene-4H-thieno[3,2-b]pyridin-5-olate Openeye Name: 3-cyano-2-(2-morpholinoethylsulfanyl)-7-oxo-4H-thieno[3,2-b]pyridin-5-olate CAS Name: 3-cyano-2-[2-(4-morpholinyl)ethylthio]-7-oxo-4H-thieno[3,2-b]pyridin-5-olate IUPAC Name: 3-cyano-2-(2-morpholin-4-ylethylsulfanyl)-7-oxo-4H-thieno[3,2-b]pyridin-5-olate Traditional Name: 3-cyano-7-keto-2-(2-morpholinoethylthio)-4H-thieno[3,2-b]pyridin-5-olate Formula: C14H14N3O3S2- MolecularWeight: 336.40926

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1CCSC2=C(C3=C(S2)C(=O)C=C(N3)[O-])C#N

Isomeric SMILES

C1COCCN1CCSC2=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