N-(2-cyano-3,3-dimethyl-7-oxidanylidene-4-thia-1-azabicyclo[3.2.0]heptan-6-yl)-2-phenyl-ethanamide

Systemtic Name: N-(2-cyano-3,3-dimethyl-7-oxidanylidene-4-thia-1-azabicyclo[3.2.0]heptan-6-yl)-2-phenyl-ethanamide Openeye Name: N-(2-cyano-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptan-6-yl)-2-phenyl-acetamide CAS Name: N-(2-cyano-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptan-6-yl)-2-phenylacetamide IUPAC Name: N-(2-cyano-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptan-6-yl)-2-phenylacetamide Traditional Name: N-(2-cyano-7-keto-3,3-dimethyl-4-thia-1-azabicyclo[3.2.0]heptan-6-yl)-2-phenyl-acetamide Formula: C16H17N3O2S MolecularWeight: 315.39008

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Descriptors Computed from Structure

Canonical SMILES:

CC1(C(N2C(S1)C(C2=O)NC(=O)CC3=CC=CC=C3)C#N)C

Isomeric SMILES

CC1(C(N2C(S1)C(C2=O)NC(=O)CC3=CC=CC=C3)C#N)C

InChI

InChI=1S/C16H17N3O2S/c1-16(2)11(9-17)19-14(21)13(15(19)22-16)18-12(20)8-10-6-4-3-5-7-10/h3-7,11,13,15H,8H2,1-2H3,(H,18,20)