Vitas-M small molecule compound
(2Z)-2-cyano-3-{3-[3-methyl-4-(propan-2-yloxy)phenyl]-1-phenyl-1H-pyrazol-4-yl}-N-(pyridin-3-ylmethyl)prop-2-enamide
Catalog ID
STK798215
SMILES N#C/C(=C/c1cn(nc1c1ccc(c(c1)C)OC(C)C)c1ccccc1)/C(=O)NCc1cccnc1
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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 C29H27N5O2 MW 477.57 g/mol Purity >90% as per NMR
InChI
InChI=1S/C29H27N5O2/c1-20(2)36-27-12-11-23(14-21(27)3)28-25(19-34(33-28)26-9-5-4-6-10-26)15-24(16-30)29(35)32-18-22-8-7-13-31-17-22/h4-15,17,19-20H,18H2,1-3H3,(H,32,35)/b24-15-InChIKey
ADYLLPSVQLYCKZ-IWIPYMOSSA-NSynonyms
(2Z)2cyano3(3(3methyl4(propan2yloxy)phenyl)1phenyl1Hpyrazol4yl)N(pyridin3ylmethyl)prop2enamide
(Z)2CYANO3(3(3METHYL4PROPAN2YLOXYPHENYL)1PHENYLPYRAZOL4YL)N(PYRIDIN3YLMETHYL)PROP2ENAMIDE
CC1=C(C=CC(=C1)C2=NN(C=C2C=C(C#N)C(=O)NCC3=CN=CC=C3)C4=CC=CC=C4)OC(C)C
InChI=1SC29H27N5O2c120(2)3627121123(1421(27)3)2825(1934(3328)2695461026)1524(1630)29(35)3218228713311722h415171920H18H213H3(H3235)b2415
MFCD03461915
N#CC(=Cc1cn(nc1c1ccc(c(c1)C)OC(C)C)c1ccccc1)C(=O)NCc1cccnc1
ZINC000016700234
ZINC16700234
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