Vitas-M small molecule compound

(2E)-N-[1-(2-chloro-6-fluorobenzyl)-3,5-dimethyl-1H-pyrazol-4-yl]-3-(1-ethyl-1H-pyrazol-4-yl)prop-2-enamide

Catalog ID
STK317552
SMILES CCn1ncc(c1)/C=C/C(=O)Nc1c(C)nn(c1C)Cc1c(F)cccc1Cl

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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 C20H21ClFN5O MW 401.87 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H21ClFN5O/c1-4-26-11-15(10-23-26)8-9-19(28)24-20-13(2)25-27(14(20)3)12-16-17(21)6-5-7-18(16)22/h5-11H,4,12H2,1-3H3,(H,24,28)/b9-8+
InChIKey
OIQDTCYCHFHMJO-CMDGGOBGSA-N
Synonyms
515858-44-3
(2E)N(1(2chloro6fluorobenzyl)35dimethyl1Hpyrazol4yl)3(1ethyl1Hpyrazol4yl)prop2enamide
(E)N(1((2CHLORO6FLUOROPHENYL)METHYL)35DIMETHYLPYRAZOL4YL)3(1ETHYLPYRAZOL4YL)PROP2ENAMIDE
515858443
CCN1C=C(C=N1)C=CC(=O)NC2=C(N(N=C2C)CC3=C(C=CC=C3Cl)F)C
CCn1ncc(c1)C=CC(=O)Nc1c(C)nn(c1C)Cc1c(F)cccc1Cl
InChI=1SC20H21ClFN5Oc14261115(102326)8919(28)242013(2)2527(14(20)3)121617(21)65718(16)22h511H412H213H3(H2428)b98+
MFCD02373599
ZINC000002770371
ZINC02770371
ZINC2770371

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Available files

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