Vitas-M small molecule compound
(2E)-N-[5-(3-chloro-4-methylbenzyl)-1,3-thiazol-2-yl]-3-(2-chlorophenyl)-2-cyanoprop-2-enamide
Catalog ID
STL017047
SMILES N#C/C(=C\c1ccccc1Cl)/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 C21H15Cl2N3OS MW 428.34 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H15Cl2N3OS/c1-13-6-7-14(9-19(13)23)8-17-12-25-21(28-17)26-20(27)16(11-24)10-15-4-2-3-5-18(15)22/h2-7,9-10,12H,8H2,1H3,(H,25,26,27)/b16-10+InChIKey
LGKCFRRMHKGJJY-MHWRWJLKSA-NSynonyms
(2E)N(5((3CHLORO4METHYLPHENYL)METHYL)(13THIAZOL2YL))3(2CHLOROPHENYL)2CYANOPROP2ENAMIDE
(2E)N(5(3chloro4methylbenzyl)13thiazol2yl)3(2chlorophenyl)2cyanoprop2enamide
(E)N(5((3chloro4methylphenyl)methyl)13thiazol2yl)3(2chlorophenyl)2cyanoprop2enamide
CC1=C(C=C(C=C1)CC2=CN=C(S2)NC(=O)C(=CC3=CC=CC=C3Cl)C#N)Cl
InChI=1SC21H15Cl2N3OSc1136714(919(13)23)817122521(2817)2620(27)16(1124)1015423518(15)22h2791012H8H21H3(H252627)b1610+
MFCD02979584
N#CC(=Cc1ccccc1Cl)C(=O)Nc1ncc(s1)Cc1ccc(c(c1)Cl)C
ZINC000000954303
ZINC00954303
ZINC954303
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