Vitas-M small molecule compound
2-(5-methyl-1,3,4-thiadiazol-2-yl)-5-nitro-1H-isoindole-1,3(2H)-dione
Catalog ID
STK155974
SMILES Cc1nnc(s1)N1C(=O)c2c(C1=O)ccc(c2)[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 C11H6N4O4S MW 290.26 g/mol Purity >90% as per NMR
InChI
InChI=1S/C11H6N4O4S/c1-5-12-13-11(20-5)14-9(16)7-3-2-6(15(18)19)4-8(7)10(14)17/h2-4H,1H3InChIKey
CKKMUHNCERUBPK-UHFFFAOYSA-NSynonyms
362000-31-52(5METHYL134THIADIAZOL2YL)5NITRO1HISOINDOLE13(2H)DIONE
2(5METHYL134THIADIAZOL2YL)5NITROISOINDOLE13DIONE
2(5methyl134thiadiazol2yl)5nitroisoindoline13dione
362000315
CC1=NN=C(S1)N2C(=O)C3=C(C2=O)C=C(C=C3)(N+)(=O)(O)
Cc1nnc(s1)N1C(=O)c2c(C1=O)ccc(c2)(N+)(=O)(O)
InChI=1SC11H6N4O4Sc15121311(205)149(16)7326(15(18)19)48(7)10(14)17h24H1H3
MFCD02031851
ZINC000000087856
ZINC00087856
ZINC87856
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