Vitas-M small molecule compound
N-[(2-fluoro-5-nitrophenyl)carbamothioyl]-3-methylbutanamide
Catalog ID
STK030523
SMILES CC(CC(=O)NC(=S)Nc1cc(ccc1F)[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 C12H14FN3O3S MW 299.33 g/mol Purity >90% as per NMR
InChI
InChI=1S/C12H14FN3O3S/c1-7(2)5-11(17)15-12(20)14-10-6-8(16(18)19)3-4-9(10)13/h3-4,6-7H,5H2,1-2H3,(H2,14,15,17,20)InChIKey
YQUXVMOKOXRNBA-UHFFFAOYSA-NSynonyms
CC(C)CC(=O)NC(=S)NC1=C(C=CC(=C1)(N+)(=O)(O))F
CC(CC(=O)NC(=S)Nc1cc(ccc1F)(N+)(=O)(O))C
InChI=1SC12H14FN3O3Sc17(2)511(17)1512(20)141068(16(18)19)349(10)13h3467H5H212H3(H214151720)
MFCD03031145
N((2FLUORO5NITROPHENYL)CARBAMOTHIOYL)3METHYLBUTANAMIDE
STK030523
ZINC000000455908
ZINC00455908
ZINC455908
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