Vitas-M small molecule compound
(2E)-3-[1-(3-bromobenzyl)-1H-indol-3-yl]-2-cyano-N-cyclopropylprop-2-enamide
Catalog ID
STK439910
SMILES N#C/C(=C\c1cn(c2c1cccc2)Cc1cccc(c1)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/c23-18-5-3-4-15(10-18)13-26-14-17(20-6-1-2-7-21(20)26)11-16(12-24)22(27)25-19-8-9-19/h1-7,10-11,14,19H,8-9,13H2,(H,25,27)/b16-11+InChIKey
QHLUKUOKFYQOKY-LFIBNONCSA-NSynonyms
(2E)3(1((3BROMOPHENYL)METHYL)INDOL3YL)2CYANONCYCLOPROPYLPROP2ENAMIDE
(2E)3(1(3bromobenzyl)1Hindol3yl)2cyanoNcyclopropylprop2enamide
(E)3(1((3BROMOPHENYL)METHYL)INDOL3YL)2CYANONCYCLOPROPYLPROP2ENAMIDE
C1CC1NC(=O)C(=CC2=CN(C3=CC=CC=C32)CC4=CC(=CC=C4)Br)C#N
InChI=1SC22H18BrN3Oc231853415(1018)13261417(20612721(20)26)1116(1224)22(27)25198919h1710111419H8913H2(H2527)b1611+
MFCD03946095
N#CC(=Cc1cn(c2c1cccc2)Cc1cccc(c1)Br)C(=O)NC1CC1
ZINC000017092102
ZINC17092102
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