Vitas-M small molecule compound

methyl 5-bromo-3-{[(prop-2-en-1-yloxy)carbonyl]amino}-1H-indole-2-carboxylate

Catalog ID
STK539473
SMILES COC(=O)c1c(NC(=O)OCC=C)c2c([nH]1)ccc(c2)Br

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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 C14H13BrN2O4 MW 353.17 g/mol Purity >90% as per NMR
InChI
InChI=1S/C14H13BrN2O4/c1-3-6-21-14(19)17-11-9-7-8(15)4-5-10(9)16-12(11)13(18)20-2/h3-5,7,16H,1,6H2,2H3,(H,17,19)
InChIKey
GDLMDTSDBSFQCK-UHFFFAOYSA-N
Synonyms
371925-38-1
371925381
COC(=O)C1=C(C2=C(N1)C=CC(=C2)Br)NC(=O)OCC=C
COC(=O)c1c(NC(=O)OCC=C)c2c((nH)1)ccc(c2)Br
InChI=1SC14H13BrN2O4c1362114(19)1711978(15)4510(9)1612(11)13(18)202h35716H16H22H3(H1719)
methyl3(((allyloxy)carbonyl)amino)5bromo1Hindole2carboxylate
methyl5bromo3(((prop2en1yloxy)carbonyl)amino)1Hindole2carboxylate
METHYL5BROMO3(PROP2ENOXYCARBONYLAMINO)1HINDOLE2CARBOXYLATE
MFCD03007291
ZINC000002313555
ZINC02313555
ZINC2313555

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.