Vitas-M small molecule compound

N-[(1Z)-1-(1,3-benzodioxol-5-yl)-3-{[2-(2-methyl-1H-indol-3-yl)ethyl]amino}-3-oxoprop-1-en-2-yl]-3-bromobenzamide

Catalog ID
STK682057
SMILES Brc1cccc(c1)C(=O)N/C(=C\c1ccc2c(c1)OCO2)/C(=O)NCCc1c(C)[nH]c2c1cccc2

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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 C28H24BrN3O4 MW 546.42 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H24BrN3O4/c1-17-21(22-7-2-3-8-23(22)31-17)11-12-30-28(34)24(32-27(33)19-5-4-6-20(29)15-19)13-18-9-10-25-26(14-18)36-16-35-25/h2-10,13-15,31H,11-12,16H2,1H3,(H,30,34)(H,32,33)/b24-13-
InChIKey
WBRMCSFTWNNZQP-CFRMEGHHSA-N
Synonyms
Brc1cccc(c1)C(=O)NC(=Cc1ccc2c(c1)OCO2)C(=O)NCCc1c(C)(nH)c2c1cccc2
CC1=C(C2=CC=CC=C2N1)CCNC(=O)C(=CC3=CC4=C(C=C3)OCO4)NC(=O)C5=CC(=CC=C5)Br
N((1Z)1(13benzodioxol5yl)3((2(2methyl1Hindol3yl)ethyl)amino)3oxoprop1en2yl)3bromobenzamide
N((Z)1(13BENZODIOXOL5YL)3(2(2METHYL1HINDOL3YL)ETHYLAMINO)3OXOPROP1EN2YL)3BROMOBENZAMIDE
Registry IDs
MFCD03821169
ZINC000003626698
ZINC3626698

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Available files

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