Vitas-M small molecule compound

4-{[2-(methylcarbamoyl)phenyl]amino}-4-oxobutanoic acid

Catalog ID
STL066272
SMILES CNC(=O)c1ccccc1NC(=O)CCC(=O)O

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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 C12H14N2O4 MW 250.25 g/mol Purity >90% as per NMR
InChI
InChI=1S/C12H14N2O4/c1-13-12(18)8-4-2-3-5-9(8)14-10(15)6-7-11(16)17/h2-5H,6-7H2,1H3,(H,13,18)(H,14,15)(H,16,17)
InChIKey
JPDKXUJGAHNPTE-UHFFFAOYSA-N
Synonyms

3(N(2(NMETHYLCARBAMOYL)PHENYL)CARBAMOYL)PROPANOICACID
4((2(methylcarbamoyl)phenyl)amino)4oxobutanoicacid
4(2((METHYLAMINO)CARBONYL)ANILINO)4OXOBUTANOICACID
4(2(METHYLCARBAMOYL)ANILINO)4OXOBUTANOICACID
CNC(=O)C1=CC=CC=C1NC(=O)CCC(=O)O
InChI=1SC12H14N2O4c11312(18)842359(8)1410(15)6711(16)17h25H67H21H3(H1318)(H1415)(H1617)
MFCD07552442
ZINC000001558557
ZINC1558557

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Available files

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