Vitas-M small molecule compound

2-chloro-1-[2-(4-methoxyphenyl)-3-[(4-methylphenyl)sulfonyl]tetrahydropyrimidin-1(2H)-yl]ethanone

Catalog ID
STK212646
SMILES ClCC(=O)N1CCCN(C1c1ccc(cc1)OC)S(=O)(=O)c1ccc(cc1)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 C20H23ClN2O4S MW 422.93 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H23ClN2O4S/c1-15-4-10-18(11-5-15)28(25,26)23-13-3-12-22(19(24)14-21)20(23)16-6-8-17(27-2)9-7-16/h4-11,20H,3,12-14H2,1-2H3
InChIKey
FPZVDOFXPPHVNU-UHFFFAOYSA-N
Synonyms

2chloro1(2(4methoxyphenyl)3((4methylphenyl)sulfonyl)tetrahydropyrimidin1(2H)yl)ethanone
2chloro1(2(4methoxyphenyl)3(4methylphenyl)sulfonyl13diazinan1yl)ethanone
CC1=CC=C(C=C1)S(=O)(=O)N2CCCN(C2C3=CC=C(C=C3)OC)C(=O)CCl
InChI=1SC20H23ClN2O4Sc11541018(11515)28(2526)231331222(19(24)1421)20(23)166817(272)9716h41120H31214H212H3
MFCD03634471
ZINC000012867503
ZINC000012867512

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Available files

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