2,2,2-Trichloroethyl 3-[(1,3-benzothiazol-2-ylsulfanyl)methyl]-7-[(methoxycarbonyl)amino]-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylate 5,5-dioxide

SpectraBase Compound ID	G2tUzrCkFsn
InChI	InChI=1S/C19H16Cl3N3O7S3/c1-31-17(28)24-12-14(26)25-13(16(27)32-8-19(20,21)22)9(7-35(29,30)15(12)25)6-33-18-23-10-4-2-3-5-11(10)34-18/h2-5,12,15H,6-8H2,1H3,(H,24,28)
InChIKey	UTOUQPILCTYHKC-UHFFFAOYSA-N Google Search
Mol Weight	600.89 g/mol
Molecular Formula	C19H16Cl3N3O7S3
Exact Mass	598.921596 g/mol

View the Full Spectrum for FREE!

SpectraBase Spectrum ID	AlnWI23lXyP
Name	2,2,2-Trichloroethyl 3-[(1,3-benzothiazol-2-ylsulfanyl)methyl]-7-[(methoxycarbonyl)amino]-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylate 5,5-dioxide
Alternate Name(s)	2,2,2-Trichloroethyl 3-[(benzothiazol-2-yl)thiomethyl]-7-methoxycarbonylamino-3-cephem-4-carboxylate 1,1-dioxide 3-[(1,3-benzothiazol-2-ylthio)methyl]-7-(methoxycarbonylamino)-5,5,8-trioxo-5$l^{6}-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid 2,2,2-trichloroethyl ester 2,2,2-trichloroethyl 3-(1,3-benzothiazol-2-ylsulfanylmethyl)-7-(methoxycarbonylamino)-5,5,8-trioxo-5$l^{6}-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylate 2,2,2-tris(chloranyl)ethyl 3-(1,3-benzothiazol-2-ylsulfanylmethyl)-7-(methoxycarbonylamino)-5,5,8-tris(oxidanylidene)-5$l^{6}-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylate
CAS Registry Number	97609-93-3
Copyright	Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula	C19H16Cl3N3O7S3
InChI	InChI=1S/C19H16Cl3N3O7S3/c1-31-17(28)24-12-14(26)25-13(16(27)32-8-19(20,21)22)9(7-35(29,30)15(12)25)6-33-18-23-10-4-2-3-5-11(10)34-18/h2-5,12,15H,6-8H2,1H3,(H,24,28)
InChIKey	UTOUQPILCTYHKC-UHFFFAOYSA-N
Molecular Weight	600.890 g/mol
SMILES	N(C1C2N(C1=O)C(=C(CS2(=O)=O)CSc1nc2ccccc2s1)C(=O)OCC(Cl)(Cl)Cl)C(=O)OC
SPLASH	splash10-066u-0912100000-f983d6e2fbd085e5fc99
Source of Spectrum	W5-1989-38579-26957
Wiley ID	1410032