Vitas-M small molecule compound
(2E)-3-[1-(4-chlorobenzyl)-1H-indol-3-yl]-N-(3-chlorophenyl)-2-cyanoprop-2-enamide
Catalog ID
STK180880
SMILES N#C/C(=C\c1cn(c2c1cccc2)Cc1ccc(cc1)Cl)/C(=O)Nc1cccc(c1)Cl
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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 C25H17Cl2N3O MW 446.33 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H17Cl2N3O/c26-20-10-8-17(9-11-20)15-30-16-19(23-6-1-2-7-24(23)30)12-18(14-28)25(31)29-22-5-3-4-21(27)13-22/h1-13,16H,15H2,(H,29,31)/b18-12+InChIKey
IMYUUDTZLFYOGG-LDADJPATSA-NSynonyms
(2E)3(1(4CHLOROBENZYL)1HINDOL3YL)N(3CHLOROPHENYL)2CYANOPROP2ENAMIDE
(E)N(3chlorophenyl)3(1((4chlorophenyl)methyl)indol3yl)2cyanoprop2enamide
C1=CC=C2C(=C1)C(=CN2CC3=CC=C(C=C3)Cl)C=C(C#N)C(=O)NC4=CC(=CC=C4)Cl
InChI=1SC25H17Cl2N3Oc262010817(91120)15301619(23612724(23)30)1218(1428)25(31)292253421(27)1322h11316H15H2(H2931)b1812+
MFCD06664283
N#CC(=Cc1cn(c2c1cccc2)Cc1ccc(cc1)Cl)C(=O)Nc1cccc(c1)Cl
ZINC000002726991
ZINC02726991
ZINC2726991
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