Vitas-M small molecule compound
1-[5-(methylsulfanyl)-3-(4-nitrophenyl)-1H-1,2,4-triazol-1-yl]ethanone
Catalog ID
STK759875
SMILES CSc1nc(nn1C(=O)C)c1ccc(cc1)[N+](=O)[O-]
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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 C11H10N4O3S MW 278.29 g/mol Purity >90% as per NMR
InChI
InChI=1S/C11H10N4O3S/c1-7(16)14-11(19-2)12-10(13-14)8-3-5-9(6-4-8)15(17)18/h3-6H,1-2H3InChIKey
MWQSUSMEIQAOJV-UHFFFAOYSA-NSynonyms
1(5(methylsulfanyl)3(4nitrophenyl)1H124triazol1yl)ethanone
1(5METHYLSULFANYL3(4NITROPHENYL)124TRIAZOL1YL)ETHANONE
1ACETYL5METHYLTHIO3(4NITROPHENYL)124TRIAZOLE
CC(=O)N1C(=NC(=N1)C2=CC=C(C=C2)(N+)(=O)(O))SC
CSc1nc(nn1C(=O)C)c1ccc(cc1)(N+)(=O)(O)
InChI=1SC11H10N4O3Sc17(16)1411(192)1210(1314)8359(648)15(17)18h36H12H3
MFCD01422973
ZINC000000033358
ZINC00033358
ZINC33358
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