Vitas-M small molecule compound

Catalog ID
STK599293
SMILES CCC([C@@H](C(=O)O)NC(=O)Nc1ccc(c(c1)Cl)OC)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 C14H19ClN2O4 MW 314.77 g/mol Purity >90% as per NMR
InChI
InChI=1S/C14H19ClN2O4/c1-4-8(2)12(13(18)19)17-14(20)16-9-5-6-11(21-3)10(15)7-9/h5-8,12H,4H2,1-3H3,(H,18,19)(H2,16,17,20)/t8?,12-/m0/s1
InChIKey
ZYALOEVGEPBFDO-MYIOLCAUSA-N
Synonyms
1173673-40-9
(2S)2((3chloro4methoxyphenyl)carbamoylamino)3methylpentanoicacid
(2S3R)2(3(3chloro4methoxyphenyl)ureido)3methylpentanoicacid
1173673409
CCC((C@@H)(C(=O)O)NC(=O)Nc1ccc(c(c1)Cl)OC)C
CCC(C)C(C(=O)O)NC(=O)NC1=CC(=C(C=C1)OC)Cl
InChI=1SC14H19ClN2O4c148(2)12(13(18)19)1714(20)1695611(213)10(15)79h5812H4H213H3(H1819)(H2161720)t8?12m0s1
MFCD04168583
ZINC000000538664
ZINC000013769220

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Available files

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