Vitas-M small molecule compound
3-chloro-N-[5-(2-methylpropyl)-1,3,4-thiadiazol-2-yl]-4-nitrobenzamide
Catalog ID
STK751415
SMILES CC(Cc1nnc(s1)NC(=O)c1ccc(c(c1)Cl)[N+](=O)[O-])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 C13H13ClN4O3S MW 340.79 g/mol Purity >90% as per NMR
InChI
InChI=1S/C13H13ClN4O3S/c1-7(2)5-11-16-17-13(22-11)15-12(19)8-3-4-10(18(20)21)9(14)6-8/h3-4,6-7H,5H2,1-2H3,(H,15,17,19)InChIKey
IWIXDSGATXPPSL-UHFFFAOYSA-NSynonyms
3CHLORO4NITRON(5ISOBUTYL134THIADIAZOL2YL)BENZAMIDE
3chloroN(5(2methylpropyl)134thiadiazol2yl)4nitrobenzamide
3CHLORON(5ISOBUTYL(134)THIADIAZOL2YL)4NITROBENZAMIDE
CC(C)CC1=NN=C(S1)NC(=O)C2=CC(=C(C=C2)(N+)(=O)(O))Cl
CC(Cc1nnc(s1)NC(=O)c1ccc(c(c1)Cl)(N+)(=O)(O))C
InChI=1SC13H13ClN4O3Sc17(2)511161713(2211)1512(19)83410(18(20)21)9(14)68h3467H5H212H3(H151719)
MFCD00500703
ZINC000000050564
ZINC00050564
ZINC50564
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