acetyloxymethyl 7-azanyl-3-[(5-methyl-1,3-thiazol-2-yl)carbonylsulfanylmethyl]-8-oxidanylidene-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylate

Systemtic Name: acetyloxymethyl 7-azanyl-3-[(5-methyl-1,3-thiazol-2-yl)carbonylsulfanylmethyl]-8-oxidanylidene-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylate Openeye Name: acetoxymethyl 7-amino-3-[(5-methylthiazole-2-carbonyl)sulfanylmethyl]-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylate CAS Name: 7-amino-3-[[[(5-methyl-2-thiazolyl)-oxomethyl]thio]methyl]-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid acetyloxymethyl ester IUPAC Name: acetyloxymethyl 7-amino-3-[(5-methyl-1,3-thiazole-2-carbonyl)sulfanylmethyl]-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylate Traditional Name: 7-amino-8-keto-3-[[(5-methylthiazole-2-carbonyl)thio]methyl]-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid acetoxymethyl ester Formula: C16H17N3O6S3 MolecularWeight: 443.51768

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CN=C(S1)C(=O)SCC2=C(N3C(C(C3=O)N)SC2)C(=O)OCOC(=O)C

Isomeric SMILES

CC1=CN=C(S1)C(=O)SCC2=C(N3C(C(C3=O)N)SC2)C(=O)OCOC(=O)C

InChI

InChI=1S/C16H17N3O6S3/c1-7-3-18-12(28-7)16(23)27-5-9-4-26-14-10(17)13(21)19(14)11(9)15(22)25-6-24-8(2)20/h3,10,14H,4-6,17H2,1-2H3