Vitas-M small molecule compound

5-chloro-N-(1,1-dioxidotetrahydrothiophen-3-yl)-N-(4-ethylbenzyl)-2-(ethylsulfonyl)pyrimidine-4-carboxamide

Catalog ID
STK910230
SMILES CCc1ccc(cc1)CN(C(=O)c1nc(ncc1Cl)S(=O)(=O)CC)C1CCS(=O)(=O)C1

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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 C20H24ClN3O5S2 MW 486.01 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H24ClN3O5S2/c1-3-14-5-7-15(8-6-14)12-24(16-9-10-30(26,27)13-16)19(25)18-17(21)11-22-20(23-18)31(28,29)4-2/h5-8,11,16H,3-4,9-10,12-13H2,1-2H3
InChIKey
AWZDXWCFHHXAPN-UHFFFAOYSA-N
Synonyms

5chloroN(11dioxidotetrahydrothiophen3yl)N(4ethylbenzyl)2(ethylsulfonyl)pyrimidine4carboxamide
5chloroN(11dioxothiolan3yl)N((4ethylphenyl)methyl)2ethylsulfonylpyrimidine4carboxamide
CCC1=CC=C(C=C1)CN(C2CCS(=O)(=O)C2)C(=O)C3=NC(=NC=C3Cl)S(=O)(=O)CC
InChI=1SC20H24ClN3O5S2c13145715(8614)1224(1691030(2627)1316)19(25)1817(21)112220(2318)31(2829)42h581116H349101213H212H3
MFCD06649336
ZINC000008868825
ZINC000008868828

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Available files

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