Vitas-M small molecule compound
2-(2,4-dimethylbenzyl)-1,2-benzothiazol-3(2H)-one 1,1-dioxide
Catalog ID
STK723865
SMILES Cc1ccc(c(c1)C)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 C16H15NO3S MW 301.37 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H15NO3S/c1-11-7-8-13(12(2)9-11)10-17-16(18)14-5-3-4-6-15(14)21(17,19)20/h3-9H,10H2,1-2H3InChIKey
BAVREMXJWMYCQA-UHFFFAOYSA-NSynonyms
2((24DIMETHYLPHENYL)METHYL)11DIOXO12BENZOTHIAZOL3ONE
2(24dimethylbenzyl)12benzothiazol3(2H)one11dioxide
CC1=CC(=C(C=C1)CN2C(=O)C3=CC=CC=C3S2(=O)=O)C
InChI=1SC16H15NO3Sc1117813(12(2)911)101716(18)14534615(14)21(1719)20h39H10H212H3
MFCD00469668
ZINC000000042674
ZINC00042674
ZINC42674
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