Vitas-M small molecule compound

5-chloro-2-[(2-chlorobenzyl)sulfanyl]-N-{4-[(4-ethoxyphenyl)amino]-4-oxobutyl}pyrimidine-4-carboxamide

Catalog ID
STL218872
SMILES CCOc1ccc(cc1)NC(=O)CCCNC(=O)c1nc(ncc1Cl)SCc1ccccc1Cl

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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 C24H24Cl2N4O3S MW 519.45 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H24Cl2N4O3S/c1-2-33-18-11-9-17(10-12-18)29-21(31)8-5-13-27-23(32)22-20(26)14-28-24(30-22)34-15-16-6-3-4-7-19(16)25/h3-4,6-7,9-12,14H,2,5,8,13,15H2,1H3,(H,27,32)(H,29,31)
InChIKey
DEDFMLGSHAGXBB-UHFFFAOYSA-N
Synonyms

5chloro2((2chlorobenzyl)sulfanyl)N(4((4ethoxyphenyl)amino)4oxobutyl)pyrimidine4carboxamide
5chloro2((2chlorophenyl)methylsulfanyl)N(4(4ethoxyanilino)4oxobutyl)pyrimidine4carboxamide
CCOC1=CC=C(C=C1)NC(=O)CCCNC(=O)C2=NC(=NC=C2Cl)SCC3=CC=CC=C3Cl
InChI=1SC24H24Cl2N4O3Sc12331811917(101218)2921(31)85132723(32)2220(26)142824(3022)341516634719(16)25h346791214H2581315H21H3(H2732)(H2931)
MFCD18081896
ZINC000041157836
ZINC41157836

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Available files

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