Vitas-M small molecule compound

ethyl 3,5-dimethyl-4-{[(methylsulfonyl)(2-phenylethyl)amino]methyl}-1H-pyrrole-2-carboxylate

Catalog ID
STK773742
SMILES CCOC(=O)c1[nH]c(c(c1C)CN(S(=O)(=O)C)CCc1ccccc1)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 C19H26N2O4S MW 378.49 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H26N2O4S/c1-5-25-19(22)18-14(2)17(15(3)20-18)13-21(26(4,23)24)12-11-16-9-7-6-8-10-16/h6-10,20H,5,11-13H2,1-4H3
InChIKey
CDFKWRVIHPLOSQ-UHFFFAOYSA-N
Synonyms

CCOC(=O)c1(nH)c(c(c1C)CN(S(=O)(=O)C)CCc1ccccc1)C
CCOC(=O)C1=C(C(=C(N1)C)CN(CCC2=CC=CC=C2)S(=O)(=O)C)C
ethyl35dimethyl4(((methylsulfonyl)(2phenylethyl)amino)methyl)1Hpyrrole2carboxylate
ethyl35dimethyl4((methylsulfonyl(2phenylethyl)amino)methyl)1Hpyrrole2carboxylate
ETHYL35DIMETHYL4((METHYLSULFONYL(PHENETHYL)AMINO)METHYL)1HPYRROLE2CARBOXYLATE
InChI=1SC19H26N2O4Sc152519(22)1814(2)17(15(3)2018)1321(26(423)24)12111697681016h61020H51113H214H3
MFCD03855546
ZINC000001080763
ZINC01080763
ZINC1080763

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Available files

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