6-(2-methylpropyl)-4-methylsulfanyl-2-oxidanylidene-pyran-3-carbonitrile

Systemtic Name: 6-(2-methylpropyl)-4-methylsulfanyl-2-oxidanylidene-pyran-3-carbonitrile Openeye Name: 6-isobutyl-4-methylsulfanyl-2-oxo-pyran-3-carbonitrile CAS Name: 6-(2-methylpropyl)-4-(methylthio)-2-oxo-3-pyrancarbonitrile IUPAC Name: 6-(2-methylpropyl)-4-methylsulfanyl-2-oxopyran-3-carbonitrile Traditional Name: 6-isobutyl-2-keto-4-(methylthio)pyran-3-carbonitrile Formula: C11H13NO2S MolecularWeight: 223.29142

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC1=CC(=C(C(=O)O1)C#N)SC

Isomeric SMILES

CC(C)CC1=CC(=C(C(=O)O1)C#N)SC

InChI

InChI=1S/C11H13NO2S/c1-7(2)4-8-5-10(15-3)9(6-12)11(13)14-8/h5,7H,4H2,1-3H3