6-ethanoyl-3,3-dimethyl-7-oxidanylidene-6-[(2-phenylsulfanylphenyl)carbonylamino]-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid

Systemtic Name: 6-ethanoyl-3,3-dimethyl-7-oxidanylidene-6-[(2-phenylsulfanylphenyl)carbonylamino]-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid Openeye Name: 6-acetyl-3,3-dimethyl-7-oxo-6-[(2-phenylsulfanylbenzoyl)amino]-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid CAS Name: 6-acetyl-3,3-dimethyl-7-oxo-6-[[oxo-[2-(phenylthio)phenyl]methyl]amino]-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid IUPAC Name: 6-acetyl-3,3-dimethyl-7-oxo-6-[(2-phenylsulfanylbenzoyl)amino]-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid Traditional Name: 6-acetyl-7-keto-3,3-dimethyl-6-[[2-(phenylthio)benzoyl]amino]-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid Formula: C23H22N2O5S2 MolecularWeight: 470.56118

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1(C2N(C1=O)C(C(S2)(C)C)C(=O)O)NC(=O)C3=CC=CC=C3SC4=CC=CC=C4

Isomeric SMILES

CC(=O)C1(C2N(C1=O)C(C(S2)(C)C)C(=O)O)NC(=O)C3=CC=CC=C3SC4=CC=CC=C4

InChI

InChI=1S/C23H22N2O5S2/c1-13(26)23(20(30)25-17(19(28)29)22(2,3)32-21(23)25)24-18(27)15-11-7-8-12-16(15)31-14-9-5-4-6-10-14/h4-12,17,21H,1-3H3,(H,24,27)(H,28,29)