(5-methyl-2-oxidanylidene-1,3-dioxol-4-yl)methyl 7-azanyl-3-[(5-methyl-1,3,4-thiadiazol-2-yl)sulfanylmethyl]-8-oxidanylidene-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylate dihydrochloride

Systemtic Name: (5-methyl-2-oxidanylidene-1,3-dioxol-4-yl)methyl 7-azanyl-3-[(5-methyl-1,3,4-thiadiazol-2-yl)sulfanylmethyl]-8-oxidanylidene-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylate dihydrochloride Openeye Name: (5-methyl-2-oxo-1,3-dioxol-4-yl)methyl 7-amino-3-[(5-methyl-1,3,4-thiadiazol-2-yl)sulfanylmethyl]-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylate dihydrochloride CAS Name: 7-amino-3-[[(5-methyl-1,3,4-thiadiazol-2-yl)thio]methyl]-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid (5-methyl-2-oxo-1,3-dioxol-4-yl)methyl ester dihydrochloride IUPAC Name: (5-methyl-2-oxo-1,3-dioxol-4-yl)methyl 7-amino-3-[(5-methyl-1,3,4-thiadiazol-2-yl)sulfanylmethyl]-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylate dihydrochloride Traditional Name: 7-amino-8-keto-3-[[(5-methyl-1,3,4-thiadiazol-2-yl)thio]methyl]-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid (2-keto-5-methyl-1,3-dioxol-4-yl)methyl ester dihydrochloride Formula: C16H18Cl2N4O6S3 MolecularWeight: 529.43832

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(OC(=O)O1)COC(=O)C2=C(CSC3N2C(=O)C3N)CSC4=NN=C(S4)C.Cl.Cl

Isomeric SMILES

CC1=C(OC(=O)O1)COC(=O)C2=C(CSC3N2C(=O)C3N)CSC4=NN=C(S4)C.Cl.Cl

InChI

InChI=1S/C16H16N4O6S3.2ClH/c1-6-9(26-16(23)25-6)3-24-14(22)11-8(5-28-15-19-18-7(2)29-15)4-27-13-10(17)12(21)20(11)13;;/h10,13H,3-5,17H2,1-2H3;2*1H