Vitas-M small molecule compound

N'-[(E)-{4-methoxy-3-[(4-nitro-1H-pyrazol-1-yl)methyl]phenyl}methylidene]-1H-pyrazole-3-carbohydrazide

Catalog ID
STK723078
SMILES COc1ccc(cc1Cn1ncc(c1)[N+](=O)[O-])/C=N/NC(=O)c1n[nH]cc1

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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 C16H15N7O4 MW 369.34 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H15N7O4/c1-27-15-3-2-11(7-18-21-16(24)14-4-5-17-20-14)6-12(15)9-22-10-13(8-19-22)23(25)26/h2-8,10H,9H2,1H3,(H,17,20)(H,21,24)/b18-7+
InChIKey
ZMMUAAZLUXVYKH-CNHKJKLMSA-N
Synonyms
304652-74-2
(E)N(4methoxy3((4nitro1Hpyrazol1yl)methyl)benzylidene)1Hpyrazole3carbohydrazide
1HPYRAZOLE3CARBOXYLICACID(1(4METHOXY3(4NITROPYRAZOL1YLMETHYL)PHENYL)METH(E)YLIDENE)HYDRAZIDE
304652742
COC1=C(C=C(C=C1)C=NNC(=O)C2=CC=NN2)CN3C=C(C=N3)(N+)(=O)(O)
COc1ccc(cc1Cn1ncc(c1)(N+)(=O)(O))C=NNC(=O)c1n(nH)cc1
InChI=1SC16H15N7O4c127153211(7182116(24)1445172014)612(15)9221013(81922)23(25)26h2810H9H21H3(H1720)(H2124)b187+
MFCD01562068
N((E)(4methoxy3((4nitro1Hpyrazol1yl)methyl)phenyl)methylidene)1Hpyrazole3carbohydrazide
N((E)(4methoxy3((4nitropyrazol1yl)methyl)phenyl)methylideneamino)1Hpyrazole5carboxamide
ZINC000008951329
ZINC33334749

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Available files

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