Vitas-M small molecule compound
(2E)-3-[3-(4-chlorophenyl)-1H-pyrazol-4-yl]-2-cyano-N-(2,4,6-trimethylphenyl)prop-2-enamide
Catalog ID
STK469979
SMILES N#C/C(=C\c1c[nH]nc1c1ccc(cc1)Cl)/C(=O)Nc1c(C)cc(cc1C)C
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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 C22H19ClN4O MW 390.87 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H19ClN4O/c1-13-8-14(2)20(15(3)9-13)26-22(28)17(11-24)10-18-12-25-27-21(18)16-4-6-19(23)7-5-16/h4-10,12H,1-3H3,(H,25,27)(H,26,28)/b17-10+InChIKey
ZGVQOHUZPZNDRB-LICLKQGHSA-NSynonyms
(2E)3(3(4chlorophenyl)1Hpyrazol4yl)2cyanoN(246trimethylphenyl)prop2enamide
(E)3(5(4chlorophenyl)1Hpyrazol4yl)2cyanoN(246trimethylphenyl)prop2enamide
CC1=CC(=C(C(=C1)C)NC(=O)C(=CC2=C(NN=C2)C3=CC=C(C=C3)Cl)C#N)C
InChI=1SC22H19ClN4Oc113814(2)20(15(3)913)2622(28)17(1124)101812252721(18)164619(23)7516h41012H13H3(H2527)(H2628)b1710+
MFCD06668042
N#CC(=Cc1c(nH)nc1c1ccc(cc1)Cl)C(=O)Nc1c(C)cc(cc1C)C
ZINC000017079821
ZINC17079821
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