Vitas-M small molecule compound

5-chloro-N-(3,4-dimethylphenyl)-2-[(2-methylbenzyl)sulfonyl]pyrimidine-4-carboxamide

Catalog ID
STK517431
SMILES Clc1cnc(nc1C(=O)Nc1ccc(c(c1)C)C)S(=O)(=O)Cc1ccccc1C

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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 C21H20ClN3O3S MW 429.93 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H20ClN3O3S/c1-13-8-9-17(10-15(13)3)24-20(26)19-18(22)11-23-21(25-19)29(27,28)12-16-7-5-4-6-14(16)2/h4-11H,12H2,1-3H3,(H,24,26)
InChIKey
IXFUGWXLNKEHKO-UHFFFAOYSA-N
Synonyms

5CHLORANYLN(34DIMETHYLPHENYL)2((2METHYLPHENYL)METHYLSULFONYL)PYRIMIDINE4CARBOXAMIDE
5chloroN(34dimethylphenyl)2((2methylbenzyl)sulfonyl)pyrimidine4carboxamide
5CHLORON(34DIMETHYLPHENYL)2((2METHYLPHENYL)METHYLSULFONYL)4PYRIMIDINECARBOXAMIDE
5CHLORON(34DIMETHYLPHENYL)2((2METHYLPHENYL)METHYLSULFONYL)PYRIMIDINE4CARBOXAMIDE
5CHLORON(34DIMETHYLPHENYL)2(2METHYLBENZYL)SULFONYLPYRIMIDINE4CARBOXAMIDE
CC1=C(C=C(C=C1)NC(=O)C2=NC(=NC=C2Cl)S(=O)(=O)CC3=CC=CC=C3C)C
InChI=1SC21H20ClN3O3Sc1138917(1015(13)3)2420(26)1918(22)112321(2519)29(2728)1216754614(16)2h411H12H213H3(H2426)
MFCD07454913
ZINC000009206927
ZINC09206927
ZINC9206927

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Available files

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