Vitas-M small molecule compound
(2Z)-2-cyano-3-[3-(3-nitrophenyl)-1-phenyl-1H-pyrazol-4-yl]-N-(prop-2-en-1-yl)prop-2-enamide
Catalog ID
STK809384
SMILES C=CCNC(=O)/C(=C\c1cn(nc1c1cccc(c1)[N+](=O)[O-])c1ccccc1)/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 C22H17N5O3 MW 399.41 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H17N5O3/c1-2-11-24-22(28)17(14-23)12-18-15-26(19-8-4-3-5-9-19)25-21(18)16-7-6-10-20(13-16)27(29)30/h2-10,12-13,15H,1,11H2,(H,24,28)/b17-12-InChIKey
YZHZBDBWPTXENR-ATVHPVEESA-NSynonyms
(2Z)2cyano3(3(3nitrophenyl)1phenyl1Hpyrazol4yl)N(prop2en1yl)prop2enamide
(Z)2cyano3(3(3nitrophenyl)1phenylpyrazol4yl)Nprop2enylprop2enamide
C=CCNC(=O)C(=CC1=CN(N=C1C2=CC(=CC=C2)(N+)(=O)(O))C3=CC=CC=C3)C#N
C=CCNC(=O)C(=Cc1cn(nc1c1cccc(c1)(N+)(=O)(O))c1ccccc1)C#N
InChI=1SC22H17N5O3c12112422(28)17(1423)12181526(198435919)2521(18)16761020(1316)27(29)30h210121315H111H2(H2428)b1712
MFCD03461347
ZINC000016790743
ZINC16790743
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