Vitas-M small molecule compound
3-[2-(4-cyanophenyl)-2-oxoethyl]-4-methyl-1,3-thiazol-3-ium
Catalog ID
STL431442
SMILES N#Cc1ccc(cc1)C(=O)C[n+]1cscc1C
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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 C13H11N2OS MW 243.31 g/mol Purity >90% as per NMR
InChI
InChI=1S/C13H11N2OS/c1-10-8-17-9-15(10)7-13(16)12-4-2-11(6-14)3-5-12/h2-5,8-9H,7H2,1H3/q+1InChIKey
MMKQIVVCSYNSQR-UHFFFAOYSA-NSynonyms
3(2(4cyanophenyl)2oxoethyl)4methyl13thiazol3ium
4(2(4methyl13thiazol3ium3yl)acetyl)benzonitrile
CC1=CSC=(N+)1CC(=O)C2=CC=C(C=C2)C#N
InChI=1SC13H11N2OSc110817915(10)713(16)124211(614)3512h2589H7H21H3q+1
N#Cc1ccc(cc1)C(=O)C(n+)1cscc1C
ZINC000253470596
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