Vitas-M small molecule compound

N-[(3-chloro-4-methoxyphenyl)carbamoyl]valine

Catalog ID
STL055207
SMILES COc1ccc(cc1Cl)NC(=O)NC(C(=O)O)C(C)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 C13H17ClN2O4 MW 300.74 g/mol Purity >90% as per NMR
InChI
InChI=1S/C13H17ClN2O4/c1-7(2)11(12(17)18)16-13(19)15-8-4-5-10(20-3)9(14)6-8/h4-7,11H,1-3H3,(H,17,18)(H2,15,16,19)
InChIKey
PZHNYJRPCWLYDT-UHFFFAOYSA-N
Synonyms

(S)2(3(3chloro4methoxyphenyl)ureido)3methylbutanoicacid
2((3CHLORO4METHOXYPHENYL)CARBAMOYLAMINO)3METHYLBUTANOICACID
CC(C)C(C(=O)O)NC(=O)NC1=CC(=C(C=C1)OC)Cl
COc1ccc(cc1Cl)NC(=O)N(C@H)(C(=O)O)C(C)C
InChI=1SC13H17ClN2O4c17(2)11(12(17)18)1613(19)1584510(203)9(14)68h4711H13H3(H1718)(H2151619)
MFCD18192759
N((3chloro4methoxyphenyl)carbamoyl)valine
ZINC000002414199
ZINC000015990206

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Available files

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