Vitas-M small molecule compound
(2Z)-N-benzyl-2-cyano-3-{3-[3-methyl-4-(propan-2-yloxy)phenyl]-1-phenyl-1H-pyrazol-4-yl}prop-2-enamide
Catalog ID
STK798213
SMILES N#C/C(=C/c1cn(nc1c1ccc(c(c1)C)OC(C)C)c1ccccc1)/C(=O)NCc1ccccc1
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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 C30H28N4O2 MW 476.58 g/mol Purity >90% as per NMR
InChI
InChI=1S/C30H28N4O2/c1-21(2)36-28-15-14-24(16-22(28)3)29-26(20-34(33-29)27-12-8-5-9-13-27)17-25(18-31)30(35)32-19-23-10-6-4-7-11-23/h4-17,20-21H,19H2,1-3H3,(H,32,35)/b25-17-InChIKey
UJPUMTQZDCOQLG-UQQQWYQISA-NSynonyms
(2Z)Nbenzyl2cyano3(3(3methyl4(propan2yloxy)phenyl)1phenyl1Hpyrazol4yl)prop2enamide
(Z)NBENZYL2CYANO3(3(3METHYL4PROPAN2YLOXYPHENYL)1PHENYLPYRAZOL4YL)PROP2ENAMIDE
CC1=C(C=CC(=C1)C2=NN(C=C2C=C(C#N)C(=O)NCC3=CC=CC=C3)C4=CC=CC=C4)OC(C)C
InChI=1SC30H28N4O2c121(2)3628151424(1622(28)3)2926(2034(3329)27128591327)1725(1831)30(35)321923106471123h4172021H19H213H3(H3235)b2517
MFCD03461913
N#CC(=Cc1cn(nc1c1ccc(c(c1)C)OC(C)C)c1ccccc1)C(=O)NCc1ccccc1
ZINC000016700228
ZINC16700228
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