Vitas-M small molecule compound
(2Z)-2-cyano-N-(3,4-dimethylphenyl)-3-{3-[2-methyl-4-(prop-2-en-1-yloxy)phenyl]-1-phenyl-1H-pyrazol-4-yl}prop-2-enamide
Catalog ID
STK800859
SMILES C=CCOc1ccc(c(c1)C)c1nn(cc1/C=C(\C(=O)Nc1ccc(c(c1)C)C)/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 C31H28N4O2 MW 488.59 g/mol Purity >90% as per NMR
InChI
InChI=1S/C31H28N4O2/c1-5-15-37-28-13-14-29(23(4)17-28)30-25(20-35(34-30)27-9-7-6-8-10-27)18-24(19-32)31(36)33-26-12-11-21(2)22(3)16-26/h5-14,16-18,20H,1,15H2,2-4H3,(H,33,36)/b24-18-InChIKey
UNCACSVNYXQJQH-MOHJPFBDSA-NSynonyms
(2Z)2cyanoN(34dimethylphenyl)3(3(2methyl4(prop2en1yloxy)phenyl)1phenyl1Hpyrazol4yl)prop2enamide
(Z)2cyanoN(34dimethylphenyl)3(3(2methyl4prop2enoxyphenyl)1phenylpyrazol4yl)prop2enamide
C=CCOc1ccc(c(c1)C)c1nn(cc1C=C(C(=O)Nc1ccc(c(c1)C)C)C#N)c1ccccc1
CC1=C(C=C(C=C1)NC(=O)C(=CC2=CN(N=C2C3=C(C=C(C=C3)OCC=C)C)C4=CC=CC=C4)C#N)C
InChI=1SC31H28N4O2c15153728131429(23(4)1728)3025(2035(3430)2797681027)1824(1932)31(36)3326121121(2)22(3)1626h514161820H115H224H3(H3336)b2418
MFCD06642947
ZINC000016736016
ZINC16736016
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