Vitas-M small molecule compound

methyl 3-{[N-(4-methoxyphenyl)-N-(methylsulfonyl)glycyl]amino}-2-methylbenzoate

Catalog ID
STK131997
SMILES COc1ccc(cc1)N(S(=O)(=O)C)CC(=O)Nc1cccc(c1C)C(=O)OC

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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 C19H22N2O6S MW 406.46 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H22N2O6S/c1-13-16(19(23)27-3)6-5-7-17(13)20-18(22)12-21(28(4,24)25)14-8-10-15(26-2)11-9-14/h5-11H,12H2,1-4H3,(H,20,22)
InChIKey
XGMJQYFLYYVEDU-UHFFFAOYSA-N
Synonyms

CC1=C(C=CC=C1NC(=O)CN(C2=CC=C(C=C2)OC)S(=O)(=O)C)C(=O)OC
InChI=1SC19H22N2O6Sc11316(19(23)273)65717(13)2018(22)1221(28(424)25)1481015(262)11914h511H12H214H3(H2022)
METHYL3((2(4METHOXYNMETHYLSULFONYLANILINO)ACETYL)AMINO)2METHYLBENZOATE
METHYL3((N(4METHOXYPHENYL)N(METHYLSULFONYL)GLYCYL)AMINO)2METHYLBENZOATE
MFCD04351898
ZINC000004715570
ZINC04715570
ZINC4715570

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Available files

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