Vitas-M small molecule compound
2-(5-methyl-1,3,4-thiadiazol-2-yl)-4-nitro-1H-isoindole-1,3(2H)-dione
Catalog ID
STK299803
SMILES Cc1nnc(s1)N1C(=O)c2c(C1=O)cccc2[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)6-3-2-4-7(15(18)19)8(6)10(14)17/h2-4H,1H3InChIKey
PCKXYAYXGMPOIL-UHFFFAOYSA-NSynonyms
2(5methyl134thiadiazol2yl)4nitro1Hisoindole13(2H)dione
2(5methyl134thiadiazol2yl)4nitroisoindole13dione
CC1=NN=C(S1)N2C(=O)C3=C(C2=O)C(=CC=C3)(N+)(=O)(O)
Cc1nnc(s1)N1C(=O)c2c(C1=O)cccc2(N+)(=O)(O)
InChI=1SC11H6N4O4Sc15121311(205)149(16)63247(15(18)19)8(6)10(14)17h24H1H3
MFCD01974680
ZINC000005943325
ZINC05943325
ZINC5943325
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