Vitas-M small molecule compound
(2E)-3-[1-(3-chlorobenzyl)-1H-indol-3-yl]-N-[2-chloro-5-(trifluoromethyl)phenyl]-2-cyanoprop-2-enamide
Catalog ID
STK472895
SMILES N#C/C(=C\c1cn(c2c1cccc2)Cc1cccc(c1)Cl)/C(=O)Nc1cc(ccc1Cl)C(F)(F)F
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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 C26H16Cl2F3N3O MW 514.33 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H16Cl2F3N3O/c27-20-5-3-4-16(10-20)14-34-15-18(21-6-1-2-7-24(21)34)11-17(13-32)25(35)33-23-12-19(26(29,30)31)8-9-22(23)28/h1-12,15H,14H2,(H,33,35)/b17-11+InChIKey
XUUDCXMIPISXDS-GZTJUZNOSA-NSynonyms
(2E)3(1((3CHLOROPHENYL)METHYL)INDOL3YL)N(2CHLORO5(TRIFLUOROMETHYL)PHENYL)2CYANOPROP2ENAMIDE
(2E)3(1(3chlorobenzyl)1Hindol3yl)N(2chloro5(trifluoromethyl)phenyl)2cyanoprop2enamide
(E)3(1((3chlorophenyl)methyl)indol3yl)N(2chloro5(trifluoromethyl)phenyl)2cyanoprop2enamide
C1=CC=C2C(=C1)C(=CN2CC3=CC(=CC=C3)Cl)C=C(C#N)C(=O)NC4=C(C=CC(=C4)C(F)(F)F)Cl
InChI=1SC26H16Cl2F3N3Oc272053416(1020)14341518(21612724(21)34)1117(1332)25(35)33231219(26(2930)31)8922(23)28h11215H14H2(H3335)b1711+
MFCD07077214
N#CC(=Cc1cn(c2c1cccc2)Cc1cccc(c1)Cl)C(=O)Nc1cc(ccc1Cl)C(F)(F)F
ZINC000020533897
ZINC20533897
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