Vitas-M small molecule compound
N-benzyl-5-chloro-N-(1,1-dioxidotetrahydrothiophen-3-yl)-2-(ethylsulfonyl)pyrimidine-4-carboxamide
Catalog ID
STK910164
SMILES CCS(=O)(=O)c1ncc(c(n1)C(=O)N(C1CCS(=O)(=O)C1)Cc1ccccc1)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 C18H20ClN3O5S2 MW 457.96 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H20ClN3O5S2/c1-2-29(26,27)18-20-10-15(19)16(21-18)17(23)22(11-13-6-4-3-5-7-13)14-8-9-28(24,25)12-14/h3-7,10,14H,2,8-9,11-12H2,1H3InChIKey
OXNWCABILHMKAM-UHFFFAOYSA-NSynonyms
CCS(=O)(=O)C1=NC=C(C(=N1)C(=O)N(CC2=CC=CC=C2)C3CCS(=O)(=O)C3)Cl
InChI=1SC18H20ClN3O5S2c1229(2627)18201015(19)16(2118)17(23)22(11136435713)148928(2425)1214h371014H2891112H21H3
MFCD06649264
Nbenzyl5chloroN(11dioxidotetrahydrothiophen3yl)2(ethylsulfonyl)pyrimidine4carboxamide
Nbenzyl5chloroN(11dioxothiolan3yl)2ethylsulfonylpyrimidine4carboxamide
ZINC000008868656
ZINC000008868658
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