Vitas-M small molecule compound
(2Z)-N-benzyl-2-cyano-3-{3-[2-methyl-4-(prop-2-en-1-yloxy)phenyl]-1-phenyl-1H-pyrazol-4-yl}prop-2-enamide
Catalog ID
STK811572
SMILES C=CCOc1ccc(c(c1)C)c1nn(cc1/C=C(\C(=O)NCc1ccccc1)/C#N)c1ccccc1
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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 C30H26N4O2 MW 474.56 g/mol Purity >90% as per NMR
InChI
InChI=1S/C30H26N4O2/c1-3-16-36-27-14-15-28(22(2)17-27)29-25(21-34(33-29)26-12-8-5-9-13-26)18-24(19-31)30(35)32-20-23-10-6-4-7-11-23/h3-15,17-18,21H,1,16,20H2,2H3,(H,32,35)/b24-18-InChIKey
FHRSZPWCFXMHBT-MOHJPFBDSA-NSynonyms
(2Z)Nbenzyl2cyano3(3(2methyl4(prop2en1yloxy)phenyl)1phenyl1Hpyrazol4yl)prop2enamide
(Z)NBENZYL2CYANO3(3(2METHYL4PROP2ENOXYPHENYL)1PHENYLPYRAZOL4YL)PROP2ENAMIDE
C=CCOc1ccc(c(c1)C)c1nn(cc1C=C(C(=O)NCc1ccccc1)C#N)c1ccccc1
CC1=C(C=CC(=C1)OCC=C)C2=NN(C=C2C=C(C#N)C(=O)NCC3=CC=CC=C3)C4=CC=CC=C4
InChI=1SC30H26N4O2c13163627141528(22(2)1727)2925(2134(3329)26128591326)1824(1931)30(35)322023106471123h315171821H11620H22H3(H3235)b2418
MFCD06264907
ZINC000016713698
ZINC16713698
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