S-(phenylmethyl) 6-azanyl-3,3,6-trimethyl-7-oxidanylidene-4-thia-1-azabicyclo[3.2.0]heptane-2-carbothioate

Systemtic Name: S-(phenylmethyl) 6-azanyl-3,3,6-trimethyl-7-oxidanylidene-4-thia-1-azabicyclo[3.2.0]heptane-2-carbothioate Openeye Name: S-benzyl 6-amino-3,3,6-trimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carbothioate CAS Name: 6-amino-3,3,6-trimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carbothioic acid S-(phenylmethyl) ester IUPAC Name: S-benzyl 6-amino-3,3,6-trimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carbothioate Traditional Name: 6-amino-7-keto-3,3,6-trimethyl-4-thia-1-azabicyclo[3.2.0]heptane-2-carbothioic acid S-benzyl ester Formula: C16H20N2O2S2 MolecularWeight: 336.4722

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Descriptors Computed from Structure

Canonical SMILES:

CC1(C(N2C(S1)C(C2=O)(C)N)C(=O)SCC3=CC=CC=C3)C

Isomeric SMILES

CC1(C(N2C(S1)C(C2=O)(C)N)C(=O)SCC3=CC=CC=C3)C

InChI

InChI=1S/C16H20N2O2S2/c1-15(2)11(18-13(20)16(3,17)14(18)22-15)12(19)21-9-10-7-5-4-6-8-10/h4-8,11,14H,9,17H2,1-3H3