Vitas-M small molecule compound
4-methyl-3-[(2-methyl-5-nitro-1H-imidazol-1-yl)methyl]-5-(methylsulfonyl)-4H-1,2,4-triazole
Catalog ID
STK743988
SMILES [O-][N+](=O)c1cnc(n1Cc1nnc(n1C)S(=O)(=O)C)C
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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 C9H12N6O4S MW 300.30 g/mol Purity >90% as per NMR
InChI
InChI=1S/C9H12N6O4S/c1-6-10-4-8(15(16)17)14(6)5-7-11-12-9(13(7)2)20(3,18)19/h4H,5H2,1-3H3InChIKey
MYOXRPLOXPQBJT-UHFFFAOYSA-NSynonyms
(O)(N+)(=O)c1cnc(n1Cc1nnc(n1C)S(=O)(=O)C)C
4methyl3((2methyl5nitro1Himidazol1yl)methyl)5(methylsulfonyl)4H124triazole
4METHYL3((2METHYL5NITROIMIDAZOL1YL)METHYL)5METHYLSULFONYL124TRIAZOLE
CC1=NC=C(N1CC2=NN=C(N2C)S(=O)(=O)C)(N+)(=O)(O)
InChI=1SC9H12N6O4Sc161048(15(16)17)14(6)5711129(13(7)2)20(318)19h4H5H213H3
MFCD06016932
ZINC000012427677
ZINC12427677
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