3,3-dimethyl-6-[(5-methyl-3-thiophen-2-yl-1,2-oxazol-4-yl)carbonylamino]-7-oxidanylidene-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid

Systemtic Name: 3,3-dimethyl-6-[(5-methyl-3-thiophen-2-yl-1,2-oxazol-4-yl)carbonylamino]-7-oxidanylidene-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid Openeye Name: 3,3-dimethyl-6-[[5-methyl-3-(2-thienyl)isoxazole-4-carbonyl]amino]-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid CAS Name: 3,3-dimethyl-6-[[(5-methyl-3-thiophen-2-yl-4-isoxazolyl)-oxomethyl]amino]-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid IUPAC Name: 3,3-dimethyl-6-[(5-methyl-3-thiophen-2-yl-1,2-oxazole-4-carbonyl)amino]-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid Traditional Name: 7-keto-3,3-dimethyl-6-[[5-methyl-3-(2-thienyl)isoxazole-4-carbonyl]amino]-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid Formula: C17H17N3O5S2 MolecularWeight: 407.46398

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NO1)C2=CC=CS2)C(=O)NC3C4N(C3=O)C(C(S4)(C)C)C(=O)O

Isomeric SMILES

CC1=C(C(=NO1)C2=CC=CS2)C(=O)NC3C4N(C3=O)C(C(S4)(C)C)C(=O)O

InChI

InChI=1S/C17H17N3O5S2/c1-7-9(10(19-25-7)8-5-4-6-26-8)13(21)18-11-14(22)20-12(16(23)24)17(2,3)27-15(11)20/h4-6,11-12,15H,1-3H3,(H,18,21)(H,23,24)