Vitas-M small molecule compound
(2E)-3-[1-(4-bromobenzyl)-1H-indol-3-yl]-2-cyano-N-cyclopropylprop-2-enamide
Catalog ID
STK439936
SMILES N#C/C(=C\c1cn(c2c1cccc2)Cc1ccc(cc1)Br)/C(=O)NC1CC1
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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 C22H18BrN3O MW 420.31 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H18BrN3O/c23-18-7-5-15(6-8-18)13-26-14-17(20-3-1-2-4-21(20)26)11-16(12-24)22(27)25-19-9-10-19/h1-8,11,14,19H,9-10,13H2,(H,25,27)/b16-11+InChIKey
ITXGNNXQERVWFO-LFIBNONCSA-NSynonyms
(2E)3(1((4BROMOPHENYL)METHYL)INDOL3YL)2CYANONCYCLOPROPYLPROP2ENAMIDE
(2E)3(1(4bromobenzyl)1Hindol3yl)2cyanoNcyclopropylprop2enamide
(E)3(1((4BROMOPHENYL)METHYL)INDOL3YL)2CYANONCYCLOPROPYLPROP2ENAMIDE
C1CC1NC(=O)C(=CC2=CN(C3=CC=CC=C32)CC4=CC=C(C=C4)Br)C#N
InChI=1SC22H18BrN3Oc23187515(6818)13261417(20312421(20)26)1116(1224)22(27)251991019h18111419H91013H2(H2527)b1611+
MFCD03946100
N#CC(=Cc1cn(c2c1cccc2)Cc1ccc(cc1)Br)C(=O)NC1CC1
ZINC000017092101
ZINC17092101
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