2-[(4-tert-butylphenyl)methylsulfanyl]-5-oxidanyl-7-oxidanylidene-4H-thieno[3,2-b]pyridine-3-carbonitrile

Systemtic Name: 2-[(4-tert-butylphenyl)methylsulfanyl]-5-oxidanyl-7-oxidanylidene-4H-thieno[3,2-b]pyridine-3-carbonitrile Openeye Name: 2-[(4-tert-butylphenyl)methylsulfanyl]-5-hydroxy-7-oxo-4H-thieno[3,2-b]pyridine-3-carbonitrile CAS Name: 2-[(4-tert-butylphenyl)methylthio]-5-hydroxy-7-oxo-4H-thieno[3,2-b]pyridine-3-carbonitrile IUPAC Name: 2-[(4-tert-butylphenyl)methylsulfanyl]-5-hydroxy-7-oxo-4H-thieno[3,2-b]pyridine-3-carbonitrile Traditional Name: 2-[(4-tert-butylbenzyl)thio]-5-hydroxy-7-keto-4H-thieno[3,2-b]pyridine-3-carbonitrile Formula: C19H18N2O2S2 MolecularWeight: 370.48842

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H18N2O2S2/c1-19(2,3)12-6-4-11(5-7-12)10-24-18-13(9-20)16-17(25-18)14(22)8-15(23)21-16/h4-8H,10H2,1-3H3,(H2,21,22,23)