Vitas-M small molecule compound
5-bromo-N-(1,1-dioxidotetrahydrothiophen-3-yl)-2-(ethylsulfanyl)-N-(4-fluorobenzyl)pyrimidine-4-carboxamide
Catalog ID
STK518875
SMILES CCSc1ncc(c(n1)C(=O)N(C1CCS(=O)(=O)C1)Cc1ccc(cc1)F)Br
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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 C18H19BrFN3O3S2 MW 488.40 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H19BrFN3O3S2/c1-2-27-18-21-9-15(19)16(22-18)17(24)23(14-7-8-28(25,26)11-14)10-12-3-5-13(20)6-4-12/h3-6,9,14H,2,7-8,10-11H2,1H3InChIKey
NWQVPXTUNQEODF-UHFFFAOYSA-NSynonyms
912891-46-45bromoN(11dioxidotetrahydrothiophen3yl)2(ethylsulfanyl)N(4fluorobenzyl)pyrimidine4carboxamide
5bromoN(11dioxothiolan3yl)2ethylsulfanylN((4fluorophenyl)methyl)pyrimidine4carboxamide
912891464
CCSC1=NC=C(C(=N1)C(=O)N(CC2=CC=C(C=C2)F)C3CCS(=O)(=O)C3)Br
InChI=1SC18H19BrFN3O3S2c12271821915(19)16(2218)17(24)23(147828(2526)1114)10123513(20)6412h36914H2781011H21H3
MFCD12918503
ZINC000027793326
ZINC000027793329
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