6-azanyl-3,3-dimethyl-6-(4-methylphenyl)sulfanyl-7-oxidanylidene-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid

Systemtic Name: 6-azanyl-3,3-dimethyl-6-(4-methylphenyl)sulfanyl-7-oxidanylidene-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid Openeye Name: 6-amino-3,3-dimethyl-7-oxo-6-(p-tolylsulfanyl)-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid CAS Name: 6-amino-3,3-dimethyl-6-[(4-methylphenyl)thio]-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid IUPAC Name: 6-amino-3,3-dimethyl-6-(4-methylphenyl)sulfanyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid Traditional Name: 6-amino-7-keto-3,3-dimethyl-6-(p-tolylthio)-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid Formula: C15H18N2O3S2 MolecularWeight: 338.44502

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)SC2(C3N(C2=O)C(C(S3)(C)C)C(=O)O)N

Isomeric SMILES

CC1=CC=C(C=C1)SC2(C3N(C2=O)C(C(S3)(C)C)C(=O)O)N

InChI

InChI=1S/C15H18N2O3S2/c1-8-4-6-9(7-5-8)21-15(16)12(20)17-10(11(18)19)14(2,3)22-13(15)17/h4-7,10,13H,16H2,1-3H3,(H,18,19)