Vitas-M small molecule compound
3-(2-carboxyethyl)-2-methyl-1,3-benzothiazol-3-ium
Catalog ID
STK396243
SMILES OC(=O)CC[n+]1c(C)sc2c1cccc2
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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 C11H12NO2S MW 222.29 g/mol Purity >90% as per NMR
InChI
InChI=1S/C11H11NO2S/c1-8-12(7-6-11(13)14)9-4-2-3-5-10(9)15-8/h2-5H,6-7H2,1H3/p+1InChIKey
JEFFCLISTHLCQM-UHFFFAOYSA-OSynonyms
3(2carboxyethyl)2methyl13benzothiazol3ium
3(2CARBOXYETHYL)2METHYLBENZOTHIAZOL3IUM
3(2METHYL135BENZOTHIAZOL3YL)PROPANOICACID
3(2METHYL13BENZOTHIAZOL3IUM3YL)PROPANOICACID
CC1=(N+)(C2=CC=CC=C2S1)CCC(=O)O
InChI=1SC11H11NO2Sc1812(7611(13)14)9423510(9)158h25H67H21H3p+1
MFCD00602736
OC(=O)CC(n+)1c(C)sc2c1cccc2
ZINC000000294938
ZINC294938
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