Vitas-M small molecule compound
5-chloro-N-(1,1-dioxidotetrahydrothiophen-3-yl)-2-(ethylsulfonyl)-N-(furan-2-ylmethyl)pyrimidine-4-carboxamide
Catalog ID
STK911063
SMILES CCS(=O)(=O)c1ncc(c(n1)C(=O)N(C1CCS(=O)(=O)C1)Cc1ccco1)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 C16H18ClN3O6S2 MW 447.92 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H18ClN3O6S2/c1-2-28(24,25)16-18-8-13(17)14(19-16)15(21)20(9-12-4-3-6-26-12)11-5-7-27(22,23)10-11/h3-4,6,8,11H,2,5,7,9-10H2,1H3InChIKey
CAYNKEUVAAIJJF-UHFFFAOYSA-NSynonyms
5chloroN(11dioxidotetrahydrothiophen3yl)2(ethylsulfonyl)N(furan2ylmethyl)pyrimidine4carboxamide
5chloroN(11dioxothiolan3yl)2ethylsulfonylN(furan2ylmethyl)pyrimidine4carboxamide
CCS(=O)(=O)C1=NC=C(C(=N1)C(=O)N(CC2=CC=CO2)C3CCS(=O)(=O)C3)Cl
InChI=1SC16H18ClN3O6S2c1228(2425)1618813(17)14(1916)15(21)20(9124362612)115727(2223)1011h346811H257910H21H3
MFCD07425961
ZINC000008915156
ZINC000008915157
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