Vitas-M small molecule compound

methyl 4-[(E)-{2-[(3-cyclopropyl-1H-pyrazol-5-yl)carbonyl]hydrazinylidene}methyl]benzoate

Catalog ID
STK101058
SMILES COC(=O)c1ccc(cc1)/C=N/NC(=O)c1[nH]nc(c1)C1CC1

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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 C16H16N4O3 MW 312.33 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H16N4O3/c1-23-16(22)12-4-2-10(3-5-12)9-17-20-15(21)14-8-13(18-19-14)11-6-7-11/h2-5,8-9,11H,6-7H2,1H3,(H,18,19)(H,20,21)/b17-9+
InChIKey
MZTKEWIPKFTTGP-RQZCQDPDSA-N
Synonyms
1285533-01-8
(E)methyl4((2(3cyclopropyl1Hpyrazole5carbonyl)hydrazono)methyl)benzoate
1285533018
COC(=O)C1=CC=C(C=C1)C=NNC(=O)C2=NNC(=C2)C3CC3
COC(=O)c1ccc(cc1)C=NNC(=O)c1(nH)nc(c1)C1CC1
InChI=1SC16H16N4O3c12316(22)124210(3512)9172015(21)14813(181914)116711h258911H67H21H3(H1819)(H2021)b179+
METHYL4((1E)2((3CYCLOPROPYLPYRAZOL5YL)CARBONYLAMINO)2AZAVINYL)BENZOATE
METHYL4((E)((5CYCLOPROPYL1HPYRAZOLE3CARBONYL)HYDRAZINYLIDENE)METHYL)BENZOATE
METHYL4((E)(2((3CYCLOPROPYL1HPYRAZOL5YL)CARBONYL)HYDRAZINYLIDENE)METHYL)BENZOATE
MFCD01533290
ZINC000009088054
ZINC33284481

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.