Vitas-M small molecule compound

methyl (2Z)-2-cyano-3-(3-phenyl-1H-pyrazol-4-yl)prop-2-enoate

Catalog ID
STK422701
SMILES COC(=O)/C(=C\c1c[nH]nc1c1ccccc1)/C#N

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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 C14H11N3O2 MW 253.26 g/mol Purity >90% as per NMR
InChI
InChI=1S/C14H11N3O2/c1-19-14(18)11(8-15)7-12-9-16-17-13(12)10-5-3-2-4-6-10/h2-7,9H,1H3,(H,16,17)/b11-7-
InChIKey
OHVULQYMENXARB-XFFZJAGNSA-N
Synonyms

COC(=O)C(=CC1=C(NN=C1)C2=CC=CC=C2)C#N
COC(=O)C(=Cc1c(nH)nc1c1ccccc1)C#N
InChI=1SC14H11N3O2c11914(18)11(815)7129161713(12)105324610h279H1H3(H1617)b117
methyl(2Z)2cyano3(3phenyl1Hpyrazol4yl)prop2enoate
METHYL(2Z)2CYANO3(3PHENYLPYRAZOL4YL)PROP2ENOATE
methyl(Z)2cyano3(5phenyl1Hpyrazol4yl)prop2enoate
MFCD02177132
ZINC000005728237
ZINC05728237
ZINC5728237

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Available files

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