Vitas-M small molecule compound
Catalog ID
STK594858
SMILES CCC([C@H](C(=O)O)NC(=O)Nc1cccc(c1)Br)C
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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 C13H17BrN2O3 MW 329.19 g/mol Purity >90% as per NMR
InChI
InChI=1S/C13H17BrN2O3/c1-3-8(2)11(12(17)18)16-13(19)15-10-6-4-5-9(14)7-10/h4-8,11H,3H2,1-2H3,(H,17,18)(H2,15,16,19)/t8?,11-/m1/s1InChIKey
WIMLANPAAGLPOG-QHDYGNBISA-NSynonyms
(2R)2((3bromophenyl)carbamoylamino)3methylpentanoicacid
(2S3R)2(3(3bromophenyl)ureido)3methylpentanoicacid
CCC((C@@H)(C(=O)O)NC(=O)Nc1cccc(c1)Br)C
CCC((C@H)(C(=O)O)NC(=O)Nc1cccc(c1)Br)C
CCC(C)C(C(=O)O)NC(=O)NC1=CC(=CC=C1)Br
InChI=1SC13H17BrN2O3c138(2)11(12(17)18)1613(19)15106459(14)710h4811H3H212H3(H1718)(H2151619)t8?11m1s1
MFCD18158469
ZINC000006357786
ZINC000006358492
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