Vitas-M small molecule compound
5-chloro-N-(1,1-dioxidotetrahydrothiophen-3-yl)-2-(ethylsulfonyl)-N-(4-fluorobenzyl)pyrimidine-4-carboxamide
Catalog ID
STK910159
SMILES CCS(=O)(=O)c1ncc(c(n1)C(=O)N(C1CCS(=O)(=O)C1)Cc1ccc(cc1)F)Cl
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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 C18H19ClFN3O5S2 MW 475.95 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H19ClFN3O5S2/c1-2-30(27,28)18-21-9-15(19)16(22-18)17(24)23(14-7-8-29(25,26)11-14)10-12-3-5-13(20)6-4-12/h3-6,9,14H,2,7-8,10-11H2,1H3InChIKey
CYJFDYBYYPURAT-UHFFFAOYSA-NSynonyms
5chloroN(11dioxidotetrahydrothiophen3yl)2(ethylsulfonyl)N(4fluorobenzyl)pyrimidine4carboxamide
5chloroN(11dioxothiolan3yl)2ethylsulfonylN((4fluorophenyl)methyl)pyrimidine4carboxamide
CCS(=O)(=O)C1=NC=C(C(=N1)C(=O)N(CC2=CC=C(C=C2)F)C3CCS(=O)(=O)C3)Cl
InChI=1SC18H19ClFN3O5S2c1230(2728)1821915(19)16(2218)17(24)23(147829(2526)1114)10123513(20)6412h36914H2781011H21H3
MFCD06649259
ZINC000008868651
ZINC000008868654
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