3,3-dimethyl-7-oxidanylidene-6-[oxidanyl(pyridin-4-yl)methyl]-4-thia-1-azabicyclo[3.2.0]heptane-2-carbonitrile

Systemtic Name: 3,3-dimethyl-7-oxidanylidene-6-[oxidanyl(pyridin-4-yl)methyl]-4-thia-1-azabicyclo[3.2.0]heptane-2-carbonitrile Openeye Name: 6-[hydroxy(4-pyridyl)methyl]-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carbonitrile CAS Name: 6-[hydroxy(pyridin-4-yl)methyl]-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carbonitrile IUPAC Name: 6-[hydroxy(pyridin-4-yl)methyl]-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carbonitrile Traditional Name: 6-[hydroxy(4-pyridyl)methyl]-7-keto-3,3-dimethyl-4-thia-1-azabicyclo[3.2.0]heptane-2-carbonitrile Formula: C14H15N3O2S MolecularWeight: 289.3528

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Descriptors Computed from Structure

Canonical SMILES:

CC1(C(N2C(S1)C(C2=O)C(C3=CC=NC=C3)O)C#N)C

Isomeric SMILES

CC1(C(N2C(S1)C(C2=O)C(C3=CC=NC=C3)O)C#N)C

InChI

InChI=1S/C14H15N3O2S/c1-14(2)9(7-15)17-12(19)10(13(17)20-14)11(18)8-3-5-16-6-4-8/h3-6,9-11,13,18H,1-2H3