Vitas-M small molecule compound
5-chloro-N-(1,1-dioxidotetrahydrothiophen-3-yl)-N-(4-fluorobenzyl)-2-(methylsulfanyl)pyrimidine-4-carboxamide
Catalog ID
STK909859
SMILES CSc1ncc(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 C17H17ClFN3O3S2 MW 429.92 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H17ClFN3O3S2/c1-26-17-20-8-14(18)15(21-17)16(23)22(13-6-7-27(24,25)10-13)9-11-2-4-12(19)5-3-11/h2-5,8,13H,6-7,9-10H2,1H3InChIKey
WOGCLNGOVQLFGQ-UHFFFAOYSA-NSynonyms
880791-00-45chloroN(11dioxidotetrahydrothiophen3yl)N(4fluorobenzyl)2(methylsulfanyl)pyrimidine4carboxamide
5chloroN(11dioxothiolan3yl)N((4fluorophenyl)methyl)2methylsulfanylpyrimidine4carboxamide
880791004
CSC1=NC=C(C(=N1)C(=O)N(CC2=CC=C(C=C2)F)C3CCS(=O)(=O)C3)Cl
InChI=1SC17H17ClFN3O3S2c1261720814(18)15(2117)16(23)22(136727(2425)1013)9112412(19)5311h25813H67910H21H3
MFCD06649030
ZINC000008868129
ZINC000008868132
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