Vitas-M small molecule compound
(2E)-N-[5-(2-chlorobenzyl)-1,3-thiazol-2-yl]-2-cyano-3-[4-(hexyloxy)phenyl]prop-2-enamide
Catalog ID
STL017061
SMILES CCCCCCOc1ccc(cc1)/C=C(/C(=O)Nc1ncc(s1)Cc1ccccc1Cl)\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 C26H26ClN3O2S MW 480.03 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H26ClN3O2S/c1-2-3-4-7-14-32-22-12-10-19(11-13-22)15-21(17-28)25(31)30-26-29-18-23(33-26)16-20-8-5-6-9-24(20)27/h5-6,8-13,15,18H,2-4,7,14,16H2,1H3,(H,29,30,31)/b21-15+InChIKey
AHCASFABJRBFLZ-RCCKNPSSSA-NSynonyms
(2E)N(5((2CHLOROPHENYL)METHYL)(13THIAZOL2YL))2CYANO3(4HEXYLOXYPHENYL)PROP2ENAMIDE
(2E)N(5(2chlorobenzyl)13thiazol2yl)2cyano3(4(hexyloxy)phenyl)prop2enamide
(E)N(5((2CHLOROPHENYL)METHYL)13THIAZOL2YL)2CYANO3(4HEXOXYPHENYL)PROP2ENAMIDE
CCCCCCOC1=CC=C(C=C1)C=C(C#N)C(=O)NC2=NC=C(S2)CC3=CC=CC=C3Cl
CCCCCCOc1ccc(cc1)C=C(C(=O)Nc1ncc(s1)Cc1ccccc1Cl)C#N
InChI=1SC26H26ClN3O2Sc12347143222121019(111322)1521(1728)25(31)3026291823(3326)1620856924(20)27h568131518H2471416H21H3(H293031)b2115+
MFCD02979200
ZINC000001905852
ZINC01905852
ZINC1905852
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