6-[[2,4-bis(oxidanylidene)-1,5-dihydro-1,5-benzodiazepin-7-yl]carbonylamino]-3,3-dimethyl-7-oxidanylidene-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid

Systemtic Name: 6-[[2,4-bis(oxidanylidene)-1,5-dihydro-1,5-benzodiazepin-7-yl]carbonylamino]-3,3-dimethyl-7-oxidanylidene-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid Openeye Name: 6-[(2,4-dioxo-1,5-dihydro-1,5-benzodiazepine-7-carbonyl)amino]-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid CAS Name: 6-[[(2,4-dioxo-1,5-dihydro-1,5-benzodiazepin-7-yl)-oxomethyl]amino]-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid IUPAC Name: 6-[(2,4-dioxo-1,5-dihydro-1,5-benzodiazepine-7-carbonyl)amino]-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid Traditional Name: 6-[(2,4-diketo-1,5-dihydro-1,5-benzodiazepine-7-carbonyl)amino]-7-keto-3,3-dimethyl-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid Formula: C18H18N4O6S MolecularWeight: 418.42372

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Descriptors Computed from Structure

Canonical SMILES:

CC1(C(N2C(S1)C(C2=O)NC(=O)C3=CC4=C(C=C3)NC(=O)CC(=O)N4)C(=O)O)C

Isomeric SMILES

CC1(C(N2C(S1)C(C2=O)NC(=O)C3=CC4=C(C=C3)NC(=O)CC(=O)N4)C(=O)O)C

InChI

InChI=1S/C18H18N4O6S/c1-18(2)13(17(27)28)22-15(26)12(16(22)29-18)21-14(25)7-3-4-8-9(5-7)20-11(24)6-10(23)19-8/h3-5,12-13,16H,6H2,1-2H3,(H,19,23)(H,20,24)(H,21,25)(H,27,28)