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

Systemtic Name: 6-ethanoyl-3,3-dimethyl-7-oxidanylidene-6-[(4-propan-2-ylphenyl)carbonylamino]-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid Openeye Name: 6-acetyl-6-[(4-isopropylbenzoyl)amino]-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid CAS Name: 6-acetyl-3,3-dimethyl-7-oxo-6-[[oxo-(4-propan-2-ylphenyl)methyl]amino]-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid IUPAC Name: 6-acetyl-3,3-dimethyl-7-oxo-6-[(4-propan-2-ylbenzoyl)amino]-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid Traditional Name: 6-acetyl-6-(cumoylamino)-7-keto-3,3-dimethyl-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid Formula: C20H24N2O5S MolecularWeight: 404.47996

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC=C(C=C1)C(=O)NC2(C3N(C2=O)C(C(S3)(C)C)C(=O)O)C(=O)C

Isomeric SMILES

CC(C)C1=CC=C(C=C1)C(=O)NC2(C3N(C2=O)C(C(S3)(C)C)C(=O)O)C(=O)C

InChI

InChI=1S/C20H24N2O5S/c1-10(2)12-6-8-13(9-7-12)15(24)21-20(11(3)23)17(27)22-14(16(25)26)19(4,5)28-18(20)22/h6-10,14,18H,1-5H3,(H,21,24)(H,25,26)