3,3-dimethyl-7-methylidene-6-(2-phenoxypropanoylamino)-4-thia-1-azabicyclo[3.2.0]heptane-2-carbothioic S-acid

Systemtic Name: 3,3-dimethyl-7-methylidene-6-(2-phenoxypropanoylamino)-4-thia-1-azabicyclo[3.2.0]heptane-2-carbothioic S-acid Openeye Name: 3,3-dimethyl-7-methylene-6-(2-phenoxypropanoylamino)-4-thia-1-azabicyclo[3.2.0]heptane-2-carbothioic S-acid CAS Name: 3,3-dimethyl-7-methylene-6-[(1-oxo-2-phenoxypropyl)amino]-4-thia-1-azabicyclo[3.2.0]heptane-2-carbothioic S-acid IUPAC Name: 3,3-dimethyl-7-methylidene-6-(2-phenoxypropanoylamino)-4-thia-1-azabicyclo[3.2.0]heptane-2-carbothioic S-acid Traditional Name: 3,3-dimethyl-7-methylene-6-(2-phenoxypropanoylamino)-4-thia-1-azabicyclo[3.2.0]heptane-2-carbothioic S-acid Formula: C18H22N2O3S2 MolecularWeight: 378.50888

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1C2N(C1=C)C(C(S2)(C)C)C(=O)S)OC3=CC=CC=C3

Isomeric SMILES

CC(C(=O)NC1C2N(C1=C)C(C(S2)(C)C)C(=O)S)OC3=CC=CC=C3

InChI

InChI=1S/C18H22N2O3S2/c1-10-13(16-20(10)14(17(22)24)18(3,4)25-16)19-15(21)11(2)23-12-8-6-5-7-9-12/h5-9,11,13-14,16H,1H2,2-4H3,(H,19,21)(H,22,24)