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

Systemtic Name: 2-[(2-methylphenyl)methylsulfanyl]-5-oxidanyl-7-oxidanylidene-4H-thieno[3,2-b]pyridine-3-carbonitrile Openeye Name: 5-hydroxy-2-(o-tolylmethylsulfanyl)-7-oxo-4H-thieno[3,2-b]pyridine-3-carbonitrile CAS Name: 5-hydroxy-2-[(2-methylphenyl)methylthio]-7-oxo-4H-thieno[3,2-b]pyridine-3-carbonitrile IUPAC Name: 5-hydroxy-2-[(2-methylphenyl)methylsulfanyl]-7-oxo-4H-thieno[3,2-b]pyridine-3-carbonitrile Traditional Name: 5-hydroxy-7-keto-2-[(2-methylbenzyl)thio]-4H-thieno[3,2-b]pyridine-3-carbonitrile Formula: C16H12N2O2S2 MolecularWeight: 328.40868

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1CSC2=C(C3=C(S2)C(=O)C=C(N3)O)C#N

Isomeric SMILES

CC1=CC=CC=C1CSC2=C(C3=C(S2)C(=O)C=C(N3)O)C#N

InChI

InChI=1S/C16H12N2O2S2/c1-9-4-2-3-5-10(9)8-21-16-11(7-17)14-15(22-16)12(19)6-13(20)18-14/h2-6H,8H2,1H3,(H2,18,19,20)