2,2-dimethylpropanoyloxymethyl 7-[[(Z)-2-(2-azanyl-1,3-thiazol-4-yl)-4-methyl-pent-2-enoyl]amino]-8-oxidanylidene-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylate

Systemtic Name: 2,2-dimethylpropanoyloxymethyl 7-[[(Z)-2-(2-azanyl-1,3-thiazol-4-yl)-4-methyl-pent-2-enoyl]amino]-8-oxidanylidene-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylate Openeye Name: 2,2-dimethylpropanoyloxymethyl 7-[[(Z)-2-(2-aminothiazol-4-yl)-4-methyl-pent-2-enoyl]amino]-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylate CAS Name: 7-[[(Z)-2-(2-amino-4-thiazolyl)-4-methyl-1-oxopent-2-enyl]amino]-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid (2,2-dimethyl-1-oxopropoxy)methyl ester IUPAC Name: 2,2-dimethylpropanoyloxymethyl 7-[[(Z)-2-(2-amino-1,3-thiazol-4-yl)-4-methylpent-2-enoyl]amino]-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylate Traditional Name: 7-[[(Z)-2-(2-aminothiazol-4-yl)-4-methyl-pent-2-enoyl]amino]-8-keto-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid pivaloyloxymethyl ester Formula: C22H28N4O6S2 MolecularWeight: 508.61092

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C=C(C1=CSC(=N1)N)C(=O)NC2C3N(C2=O)C(=CCS3)C(=O)OCOC(=O)C(C)(C)C

Isomeric SMILES

CC(C)/C=C(/C1=CSC(=N1)N)\C(=O)NC2C3N(C2=O)C(=CCS3)C(=O)OCOC(=O)C(C)(C)C

InChI

InChI=1S/C22H28N4O6S2/c1-11(2)8-12(13-9-34-21(23)24-13)16(27)25-15-17(28)26-14(6-7-33-18(15)26)19(29)31-10-32-20(30)22(3,4)5/h6,8-9,11,15,18H,7,10H2,1-5H3,(H2,23,24)(H,25,27)/b12-8-