Vitas-M small molecule compound
7-methyl-N'-[(E)-(6-nitro-1,3-benzodioxol-5-yl)methylidene]-5-phenylpyrazolo[1,5-a]pyrimidine-3-carbohydrazide
Catalog ID
STK959961
SMILES O=C(c1cnn2c1nc(cc2C)c1ccccc1)N/N=C/c1cc2OCOc2cc1[N+](=O)[O-]
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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 C22H16N6O5 MW 444.41 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H16N6O5/c1-13-7-17(14-5-3-2-4-6-14)25-21-16(11-24-27(13)21)22(29)26-23-10-15-8-19-20(33-12-32-19)9-18(15)28(30)31/h2-11H,12H2,1H3,(H,26,29)/b23-10+InChIKey
XNEJMLSMMYBPBS-AUEPDCJTSA-NSynonyms
495377-05-4495377054
7methylN((E)(6nitro13benzodioxol5yl)methylidene)5phenylpyrazolo(15a)pyrimidine3carbohydrazide
7METHYLN((E)(6NITRO13BENZODIOXOL5YL)METHYLIDENEAMINO)5PHENYLPYRAZOLO(15A)PYRIMIDINE3CARBOXAMIDE
CC1=CC(=NC2=C(C=NN12)C(=O)NN=CC3=CC4=C(C=C3(N+)(=O)(O))OCO4)C5=CC=CC=C5
InChI=1SC22H16N6O5c113717(145324614)252116(112427(13)21)22(29)2623101581920(33123219)918(15)28(30)31h211H12H21H3(H2629)b2310+
MFCD02606730
N((6NITRO13BENZODIOXOL5YL)METHYLENE)7METHYL5PHENYLPYRAZOLO(15A)PYRIMIDINE3CARBOHYDRAZIDE
O=C(c1cnn2c1nc(cc2C)c1ccccc1)NN=Cc1cc2OCOc2cc1(N+)(=O)(O)
ZINC000000672968
ZINC33333976
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