Vitas-M small molecule compound
(2E)-3-[1-(4-chloro-3-methylphenyl)-2,5-dimethyl-1H-pyrrol-3-yl]-2-cyano-N-cycloheptylprop-2-enamide
Catalog ID
STL367599
SMILES N#C/C(=C\c1cc(n(c1C)c1ccc(c(c1)C)Cl)C)/C(=O)NC1CCCCCC1
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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 C24H28ClN3O MW 409.96 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H28ClN3O/c1-16-12-22(10-11-23(16)25)28-17(2)13-19(18(28)3)14-20(15-26)24(29)27-21-8-6-4-5-7-9-21/h10-14,21H,4-9H2,1-3H3,(H,27,29)/b20-14+InChIKey
XCWFXEYOYBDJBZ-XSFVSMFZSA-NSynonyms
(2E)3(1(4chloro3methylphenyl)25dimethyl1Hpyrrol3yl)2cyanoNcycloheptylprop2enamide
(E)3(1(4chloro3methylphenyl)25dimethylpyrrol3yl)2cyanoNcycloheptylprop2enamide
CC1=CC(=C(N1C2=CC(=C(C=C2)Cl)C)C)C=C(C#N)C(=O)NC3CCCCCC3
InChI=1SC24H28ClN3Oc1161222(101123(16)25)2817(2)1319(18(28)3)1420(1526)24(29)272186457921h101421H49H213H3(H2729)b2014+
MFCD28951864
N#CC(=Cc1cc(n(c1C)c1ccc(c(c1)C)Cl)C)C(=O)NC1CCCCCC1
ZINC000098086337
ZINC98086337
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