Vitas-M small molecule compound
methyl (2Z)-3-[1-(3-chlorobenzyl)-3-phenyl-1H-pyrazol-4-yl]-2-cyanoprop-2-enoate
Catalog ID
STK460159
SMILES N#C/C(=C/c1cn(nc1c1ccccc1)Cc1cccc(c1)Cl)/C(=O)OC
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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 C21H16ClN3O2 MW 377.83 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H16ClN3O2/c1-27-21(26)17(12-23)11-18-14-25(13-15-6-5-9-19(22)10-15)24-20(18)16-7-3-2-4-8-16/h2-11,14H,13H2,1H3/b17-11-InChIKey
YMLONDPZEUUTRT-BOPFTXTBSA-NSynonyms
COC(=O)C(=CC1=CN(N=C1C2=CC=CC=C2)CC3=CC(=CC=C3)Cl)C#N
InChI=1SC21H16ClN3O2c12721(26)17(1223)11181425(131565919(22)1015)2420(18)167324816h21114H13H21H3b1711
METHYL(2Z)3(1((3CHLOROPHENYL)METHYL)3PHENYLPYRAZOL4YL)2CYANOPROP2ENOATE
methyl(2Z)3(1(3chlorobenzyl)3phenyl1Hpyrazol4yl)2cyanoprop2enoate
methyl(Z)3(1((3chlorophenyl)methyl)3phenylpyrazol4yl)2cyanoprop2enoate
MFCD04264166
N#CC(=Cc1cn(nc1c1ccccc1)Cc1cccc(c1)Cl)C(=O)OC
ZINC000007060688
ZINC07060688
ZINC7060688
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