Vitas-M small molecule compound

methyl 4-methyl-3-(pyrrolidin-1-ylsulfonyl)benzoate

Catalog ID
STL384454
SMILES COC(=O)c1ccc(c(c1)S(=O)(=O)N1CCCC1)C

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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 C13H17NO4S MW 283.35 g/mol Purity >90% as per NMR
InChI
InChI=1S/C13H17NO4S/c1-10-5-6-11(13(15)18-2)9-12(10)19(16,17)14-7-3-4-8-14/h5-6,9H,3-4,7-8H2,1-2H3
InChIKey
DESMFPYSLKCSOF-UHFFFAOYSA-N
Synonyms

4METHYL3(PYRROLIDINE1SULFONYL)BENZOICACIDMETHYLESTER
CC1=C(C=C(C=C1)C(=O)OC)S(=O)(=O)N2CCCC2
InChI=1SC13H17NO4Sc1105611(13(15)182)912(10)19(1617)14734814h569H3478H212H3
methyl4methyl3(pyrrolidin1ylsulfonyl)benzoate
METHYL4METHYL3PYRROLIDIN1YLSULFONYLBENZOATE
MFCD07359924
ZINC000004839646
ZINC04839646
ZINC4839646

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Available files

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