Vitas-M small molecule compound

methyl 2-[(2,5-dimethylbenzyl)(methylsulfonyl)amino]benzoate

Catalog ID
STK880353
SMILES COC(=O)c1ccccc1N(S(=O)(=O)C)Cc1cc(C)ccc1C

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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 C18H21NO4S MW 347.44 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H21NO4S/c1-13-9-10-14(2)15(11-13)12-19(24(4,21)22)17-8-6-5-7-16(17)18(20)23-3/h5-11H,12H2,1-4H3
InChIKey
IKZSBVDZSVCPCL-UHFFFAOYSA-N
Synonyms
1232810-65-9
1232810659
2((25DIMETHYLBENZYL)METHANESULFONYLAMINO)BENZOICACIDMETHYLESTER
CC1=CC(=C(C=C1)C)CN(C2=CC=CC=C2C(=O)OC)S(=O)(=O)C
InChI=1SC18H21NO4Sc11391014(2)15(1113)1219(24(421)22)17865716(17)18(20)233h511H12H214H3
methyl2((25dimethylbenzyl)(methylsulfonyl)amino)benzoate
methyl2((25dimethylphenyl)methylmethylsulfonylamino)benzoate
MFCD14703580
ZINC000040478891
ZINC40478891

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Available files

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