Vitas-M small molecule compound

methyl 2-({2-(4-methylphenyl)-2-oxo-1-[(thiophen-2-ylcarbonyl)amino]ethyl}amino)benzoate

Catalog ID
STK810325
SMILES COC(=O)c1ccccc1NC(C(=O)c1ccc(cc1)C)NC(=O)c1cccs1

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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 C22H20N2O4S MW 408.48 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H20N2O4S/c1-14-9-11-15(12-10-14)19(25)20(24-21(26)18-8-5-13-29-18)23-17-7-4-3-6-16(17)22(27)28-2/h3-13,20,23H,1-2H3,(H,24,26)
InChIKey
AVWOFVGIZVYDMM-UHFFFAOYSA-N
Synonyms

CC1=CC=C(C=C1)C(=O)C(NC2=CC=CC=C2C(=O)OC)NC(=O)C3=CC=CS3
InChI=1SC22H20N2O4Sc11491115(121014)19(25)20(2421(26)1885132918)2317743616(17)22(27)282h3132023H12H3(H2426)
methyl2((2(4methylphenyl)2oxo1((thiophen2ylcarbonyl)amino)ethyl)amino)benzoate
METHYL2((2(4METHYLPHENYL)2OXO1(THIOPHENE2CARBONYLAMINO)ETHYL)AMINO)BENZOATE
MFCD03447898
ZINC000001477167
ZINC000001477168

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Available files

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