Vitas-M small molecule compound

3-({[4-(methoxycarbonyl)phenyl]carbamoyl}amino)-4-methylbenzoic acid

Catalog ID
STK489433
SMILES COC(=O)c1ccc(cc1)NC(=O)Nc1cc(ccc1C)C(=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 C17H16N2O5 MW 328.32 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H16N2O5/c1-10-3-4-12(15(20)21)9-14(10)19-17(23)18-13-7-5-11(6-8-13)16(22)24-2/h3-9H,1-2H3,(H,20,21)(H2,18,19,23)
InChIKey
NDBDERPGRPRAST-UHFFFAOYSA-N
Synonyms

3(((4(METHOXYCARBONYL)PHENYL)AMINO)CARBONYLAMINO)4METHYLBENZOICACID
3(((4(methoxycarbonyl)phenyl)carbamoyl)amino)4methylbenzoicacid
3((4methoxycarbonylphenyl)carbamoylamino)4methylbenzoicacid
CC1=C(C=C(C=C1)C(=O)O)NC(=O)NC2=CC=C(C=C2)C(=O)OC
InChI=1SC17H16N2O5c1103412(15(20)21)914(10)1917(23)18137511(6813)16(22)242h39H12H3(H2021)(H2181923)
MFCD09452161
ZINC000013746905
ZINC13746905

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Available files

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