Vitas-M small molecule compound

2-{[2-bromo-5-ethoxy-4-(prop-2-yn-1-yloxy)benzyl]amino}butan-1-ol

Catalog ID
STL181929
SMILES CCOc1cc(CNC(CO)CC)c(cc1OCC#C)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 C16H22BrNO3 MW 356.26 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H22BrNO3/c1-4-7-21-16-9-14(17)12(8-15(16)20-6-3)10-18-13(5-2)11-19/h1,8-9,13,18-19H,5-7,10-11H2,2-3H3
InChIKey
YYKFSMGTYODDCK-UHFFFAOYSA-N
Synonyms

2((2BROMO5ETHOXY4(2PROPYNYLOXY)BENZYL)AMINO)1BUTANOL
2((2bromo5ethoxy4(prop2yn1yloxy)benzyl)amino)butan1ol
2((2bromo5ethoxy4prop2ynoxyphenyl)methylamino)butan1ol
CCC(CO)NCC1=CC(=C(C=C1Br)OCC#C)OCC
InChI=1SC16H22BrNO3c1472116914(17)12(815(16)2063)101813(52)1119h189131819H571011H223H3
MFCD05884174
ZINC000004670865
ZINC000004670866

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Available files

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