Vitas-M small molecule compound
N-(1H-benzotriazol-7-yl)-2-(3,5-dimethyl-4-nitro-1H-pyrazol-1-yl)acetamide
Catalog ID
STK784744
SMILES O=C(Nc1cccc2c1[nH]nn2)Cn1nc(c(c1C)[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 C13H13N7O3 MW 315.29 g/mol Purity >90% as per NMR
InChI
InChI=1S/C13H13N7O3/c1-7-13(20(22)23)8(2)19(17-7)6-11(21)14-9-4-3-5-10-12(9)16-18-15-10/h3-5H,6H2,1-2H3,(H,14,21)(H,15,16,18)InChIKey
VJYHYJZHIDFIEC-UHFFFAOYSA-NSynonyms
CC1=C(C(=NN1CC(=O)NC2=CC=CC3=NNN=C32)C)(N+)(=O)(O)
InChI=1SC13H13N7O3c1713(20(22)23)8(2)19(177)611(21)1494351012(9)16181510h35H6H212H3(H1421)(H151618)
MFCD07023064
N(1Hbenzotriazol7yl)2(35dimethyl4nitro1Hpyrazol1yl)acetamide
N(2HBENZOTRIAZOL4YL)2(35DIMETHYL4NITROPYRAZOL1YL)ACETAMIDE
NBENZOTRIAZOL7YL2(35DIMETHYL4NITROPYRAZOLYL)ACETAMIDE
O=C(Nc1cccc2c1(nH)nn2)Cn1nc(c(c1C)(N+)(=O)(O))C
ZINC000019625985
ZINC19625985
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