N-(4-bromophenyl)-3,3-dimethyl-7-oxidanylidene-6-(2-phenylethanoylamino)-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxamide

Systemtic Name: N-(4-bromophenyl)-3,3-dimethyl-7-oxidanylidene-6-(2-phenylethanoylamino)-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxamide Openeye Name: N-(4-bromophenyl)-3,3-dimethyl-7-oxo-6-[(2-phenylacetyl)amino]-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxamide CAS Name: N-(4-bromophenyl)-3,3-dimethyl-7-oxo-6-[(1-oxo-2-phenylethyl)amino]-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxamide IUPAC Name: N-(4-bromophenyl)-3,3-dimethyl-7-oxo-6-[(2-phenylacetyl)amino]-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxamide Traditional Name: N-(4-bromophenyl)-7-keto-3,3-dimethyl-6-[(2-phenylacetyl)amino]-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxamide Formula: C22H22BrN3O3S MolecularWeight: 488.39738

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Descriptors Computed from Structure

Canonical SMILES:

CC1(C(N2C(S1)C(C2=O)NC(=O)CC3=CC=CC=C3)C(=O)NC4=CC=C(C=C4)Br)C

Isomeric SMILES

CC1(C(N2C(S1)C(C2=O)NC(=O)CC3=CC=CC=C3)C(=O)NC4=CC=C(C=C4)Br)C

InChI

InChI=1S/C22H22BrN3O3S/c1-22(2)18(19(28)24-15-10-8-14(23)9-11-15)26-20(29)17(21(26)30-22)25-16(27)12-13-6-4-3-5-7-13/h3-11,17-18,21H,12H2,1-2H3,(H,24,28)(H,25,27)