Vitas-M small molecule compound
(2E)-N-[5-(3-chloro-4-methylbenzyl)-1,3-thiazol-2-yl]-2-cyano-3-[2-(propan-2-yloxy)phenyl]prop-2-enamide
Catalog ID
STL016988
SMILES N#C/C(=C\c1ccccc1OC(C)C)/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 C24H22ClN3O2S MW 451.98 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H22ClN3O2S/c1-15(2)30-22-7-5-4-6-18(22)12-19(13-26)23(29)28-24-27-14-20(31-24)10-17-9-8-16(3)21(25)11-17/h4-9,11-12,14-15H,10H2,1-3H3,(H,27,28,29)/b19-12+InChIKey
QUALWSCYDHKMSA-XDHOZWIPSA-NSynonyms
(2E)N(5((3CHLORO4METHYLPHENYL)METHYL)(13THIAZOL2YL))2CYANO3(2(METHYLETHOXY)PHENYL)PROP2ENAMIDE
(2E)N(5(3chloro4methylbenzyl)13thiazol2yl)2cyano3(2(propan2yloxy)phenyl)prop2enamide
(E)N(5((3chloro4methylphenyl)methyl)13thiazol2yl)2cyano3(2propan2yloxyphenyl)prop2enamide
CC1=C(C=C(C=C1)CC2=CN=C(S2)NC(=O)C(=CC3=CC=CC=C3OC(C)C)C#N)Cl
InChI=1SC24H22ClN3O2Sc115(2)3022754618(22)1219(1326)23(29)2824271420(3124)10179816(3)21(25)1117h4911121415H10H213H3(H272829)b1912+
MFCD02979598
N#CC(=Cc1ccccc1OC(C)C)C(=O)Nc1ncc(s1)Cc1ccc(c(c1)Cl)C
ZINC000000954317
ZINC00954317
ZINC954317
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