Vitas-M small molecule compound
(2E)-N-[5-(3-chloro-4-methylbenzyl)-1,3-thiazol-2-yl]-2-cyano-3-(4-methoxyphenyl)prop-2-enamide
Catalog ID
STK731887
SMILES N#C/C(=C\c1ccc(cc1)OC)/C(=O)Nc1ncc(s1)Cc1ccc(c(c1)Cl)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 C22H18ClN3O2S MW 423.92 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H18ClN3O2S/c1-14-3-4-16(11-20(14)23)10-19-13-25-22(29-19)26-21(27)17(12-24)9-15-5-7-18(28-2)8-6-15/h3-9,11,13H,10H2,1-2H3,(H,25,26,27)/b17-9+InChIKey
DFOXCIGSMNQBNV-RQZCQDPDSA-NSynonyms
468772-45-4(2E)N(5(3chloro4methylbenzyl)13thiazol2yl)2cyano3(4methoxyphenyl)prop2enamide
(E)N(5((3chloro4methylphenyl)methyl)13thiazol2yl)2cyano3(4methoxyphenyl)prop2enamide
(E)N(5(3chloro4methylbenzyl)thiazol2yl)2cyano3(4methoxyphenyl)acrylamide
468772454
CC1=C(C=C(C=C1)CC2=CN=C(S2)NC(=O)C(=CC3=CC=C(C=C3)OC)C#N)Cl
InChI=1SC22H18ClN3O2Sc1143416(1120(14)23)1019132522(2919)2621(27)17(1224)9155718(282)8615h391113H10H212H3(H252627)b179+
MFCD02979592
N#CC(=Cc1ccc(cc1)OC)C(=O)Nc1ncc(s1)Cc1ccc(c(c1)Cl)C
ZINC000000954313
ZINC00954313
ZINC954313
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