Vitas-M small molecule compound

2-{[3-(2-chlorophenyl)-4,5-dihydro-1,2-oxazol-5-yl]methyl}-1,2-benzothiazol-3(2H)-one 1,1-dioxide

Catalog ID
STK697740
SMILES Clc1ccccc1C1=NOC(C1)CN1C(=O)c2c(S1(=O)=O)cccc2

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We supply compounds in quantities from 1 mg up to 5 g for research and development purposes only.

We do not supply quantities above 5 g.

Structure and other identifiers

2D representation rendered from the SMILES, with core physicochemical data.
Formula C17H13ClN2O4S MW 376.82 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H13ClN2O4S/c18-14-7-3-1-5-12(14)15-9-11(24-19-15)10-20-17(21)13-6-2-4-8-16(13)25(20,22)23/h1-8,11H,9-10H2
InChIKey
IWHIITSNGOHTAG-UHFFFAOYSA-N
Synonyms
724421-95-8
2(((5S)3(2CHLOROPHENYL)45DIHYDRO12OXAZOL5YL)METHYL)12BENZOTHIAZOL3(2H)ONE11DIOXIDE
2((3(2CHLOROPHENYL)45DIHYDRO12OXAZOL5YL)METHYL)11DIOXO12BENZOTHIAZOL3ONE
2((3(2chlorophenyl)45dihydro12oxazol5yl)methyl)12benzothiazol3(2H)one11dioxide
2((3(2CHLOROPHENYL)45DIHYDRO12OXAZOL5YL)METHYL)23DIHYDRO1
2((3(2CHLOROPHENYL)45DIHYDRO5ISOXAZOLYL)METHYL)1H12BENZISOTHIAZOLE113(2H)TRIONE
2((3(2chlorophenyl)45dihydroisoxazol5yl)methyl)benzo(d)isothiazol3(2H)one11dioxide
2(3(2CHLOROPHENYL)45DIHYDROISOXAZOL5YLMETHYL)11DIOXO12DIHYDRO1LAMBDA6BENZO(D)ISOTHIAZOL3ONE
724421958
C1C(ON=C1C2=CC=CC=C2Cl)CN3C(=O)C4=CC=CC=C4S3(=O)=O
InChI=1SC17H13ClN2O4Sc1814731512(14)15911(241915)102017(21)13624816(13)25(2022)23h1811H910H2
MFCD03644267
ZINC000001035598
ZINC000004334993

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.