Vitas-M small molecule compound
N-benzyl-3-tert-butyl-1-methyl-4-nitro-1H-pyrazole-5-carboxamide
Catalog ID
STL342439
SMILES O=C(c1n(C)nc(c1[N+](=O)[O-])C(C)(C)C)NCc1ccccc1
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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 C16H20N4O3 MW 316.36 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H20N4O3/c1-16(2,3)14-12(20(22)23)13(19(4)18-14)15(21)17-10-11-8-6-5-7-9-11/h5-9H,10H2,1-4H3,(H,17,21)InChIKey
HRIXUNUQWKTUIQ-UHFFFAOYSA-NSynonyms
395073-17-3395073173
CC(C)(C)C1=NN(C(=C1(N+)(=O)(O))C(=O)NCC2=CC=CC=C2)C
InChI=1SC16H20N4O3c116(23)1412(20(22)23)13(19(4)1814)15(21)1710118657911h59H10H214H3(H1721)
MFCD02161699
Nbenzyl3(tertbutyl)1methyl4nitro1Hpyrazole5carboxamide
Nbenzyl3tertbutyl1methyl4nitro1Hpyrazole5carboxamide
NBENZYL5TERTBUTYL2METHYL4NITROPYRAZOLE3CARBOXAMIDE
O=C(c1n(C)nc(c1(N+)(=O)(O))C(C)(C)C)NCc1ccccc1
ZINC000000533758
ZINC00533758
ZINC533758
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