Vitas-M small molecule compound
N-[(2,3-dimethylphenyl)carbamoyl]isoleucine
Catalog ID
STL047947
SMILES CCC(C(C(=O)O)NC(=O)Nc1cccc(c1C)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 C15H22N2O3 MW 278.35 g/mol Purity >90% as per NMR
InChI
InChI=1S/C15H22N2O3/c1-5-9(2)13(14(18)19)17-15(20)16-12-8-6-7-10(3)11(12)4/h6-9,13H,5H2,1-4H3,(H,18,19)(H2,16,17,20)InChIKey
VAGCSIYKJOBNPR-UHFFFAOYSA-NSynonyms
(2S3R)2(3(23dimethylphenyl)ureido)3methylpentanoicacid
2((23DIMETHYLPHENYL)CARBAMOYLAMINO)3METHYLPENTANOICACID
CCC((C@@H)(C(=O)O)NC(=O)Nc1cccc(c1C)C)C
CCC(C)C(C(=O)O)NC(=O)NC1=CC=CC(=C1C)C
InChI=1SC15H22N2O3c159(2)13(14(18)19)1715(20)161286710(3)11(12)4h6913H5H214H3(H1819)(H2161720)
MFCD18192572
N((23dimethylphenyl)carbamoyl)isoleucine
ZINC000005164120
ZINC000015989679
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