Vitas-M small molecule compound
(2Z)-3-(4-butoxyphenyl)-2-cyano-N-(1,5-dimethyl-3-oxo-2-phenyl-2,3-dihydro-1H-pyrazol-4-yl)prop-2-enamide
Catalog ID
STK701974
SMILES CCCCOc1ccc(cc1)/C=C(\C(=O)Nc1c(C)n(n(c1=O)c1ccccc1)C)/C#N
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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 C25H26N4O3 MW 430.51 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H26N4O3/c1-4-5-15-32-22-13-11-19(12-14-22)16-20(17-26)24(30)27-23-18(2)28(3)29(25(23)31)21-9-7-6-8-10-21/h6-14,16H,4-5,15H2,1-3H3,(H,27,30)/b20-16-InChIKey
MXZLTOJEDLZTDA-SILNSSARSA-NSynonyms
(2Z)3(4butoxyphenyl)2cyanoN(15dimethyl3oxo2phenyl23dihydro1Hpyrazol4yl)prop2enamide
(E)3(4butoxyphenyl)2cyanoN(15dimethyl3oxo2phenyl23dihydro1Hpyrazol4yl)acrylamide
(Z)3(4BUTOXYPHENYL)2CYANON(15DIMETHYL3OXO2PHENYLPYRAZOL4YL)PROP2ENAMIDE
CCCCOC1=CC=C(C=C1)C=C(C#N)C(=O)NC2=C(N(N(C2=O)C3=CC=CC=C3)C)C
CCCCOc1ccc(cc1)C=C(C(=O)Nc1c(C)n(n(c1=O)c1ccccc1)C)C#N
InChI=1SC25H26N4O3c145153222131119(121422)1620(1726)24(30)272318(2)28(3)29(25(23)31)2197681021h61416H4515H213H3(H2730)b2016
MFCD03225629
ZINC000026687142
ZINC26687142
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