Vitas-M small molecule compound
2-{3-[(3,5-dimethyl-4-nitro-1H-pyrazol-1-yl)methyl]phenyl}[1,2,4]triazolo[1,5-c]quinazoline
Catalog ID
STK310741
SMILES [O-][N+](=O)c1c(C)nn(c1C)Cc1cccc(c1)c1nn2c(n1)c1ccccc1nc2
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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 C21H17N7O2 MW 399.41 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H17N7O2/c1-13-19(28(29)30)14(2)26(24-13)11-15-6-5-7-16(10-15)20-23-21-17-8-3-4-9-18(17)22-12-27(21)25-20/h3-10,12H,11H2,1-2H3InChIKey
WPXDABUDUWNQBC-UHFFFAOYSA-NSynonyms
1005570-31-9(O)(N+)(=O)c1c(C)nn(c1C)Cc1cccc(c1)c1nn2c(n1)c1ccccc1nc2
1005570319
2(3((35dimethyl4nitro1Hpyrazol1yl)methyl)phenyl)(124)triazolo(15c)quinazoline
2(3((35dimethyl4nitropyrazol1yl)methyl)phenyl)(124)triazolo(15c)quinazoline
CC1=C(C(=NN1CC2=CC=CC(=C2)C3=NN4C=NC5=CC=CC=C5C4=N3)C)(N+)(=O)(O)
InChI=1SC21H17N7O2c11319(28(29)30)14(2)26(2413)111565716(1015)20232117834918(17)221227(21)2520h31012H11H212H3
MFCD04136351
ZINC000002806396
ZINC02806396
ZINC2806396
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