Vitas-M small molecule compound
methyl 3-[({5-[(1,1-dioxidotetrahydrothiophen-3-yl)sulfonyl]-2-fluorophenyl}carbonyl)amino]benzoate
Catalog ID
STK657942
SMILES COC(=O)c1cccc(c1)NC(=O)c1cc(ccc1F)S(=O)(=O)C1CCS(=O)(=O)C1
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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 C19H18FNO7S2 MW 455.48 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H18FNO7S2/c1-28-19(23)12-3-2-4-13(9-12)21-18(22)16-10-14(5-6-17(16)20)30(26,27)15-7-8-29(24,25)11-15/h2-6,9-10,15H,7-8,11H2,1H3,(H,21,22)InChIKey
NKVOXJIOXQPCAP-UHFFFAOYSA-NSynonyms
1011948-77-81011948778
COC(=O)C1=CC(=CC=C1)NC(=O)C2=C(C=CC(=C2)S(=O)(=O)C3CCS(=O)(=O)C3)F
InChI=1SC19H18FNO7S2c12819(23)1232413(912)2118(22)161014(5617(16)20)30(2627)157829(2425)1115h2691015H7811H21H3(H2122)
methyl3(((5((11dioxidotetrahydrothiophen3yl)sulfonyl)2fluorophenyl)carbonyl)amino)benzoate
methyl3((5(11dioxothiolan3yl)sulfonyl2fluorobenzoyl)amino)benzoate
methyl3(5((11dioxidotetrahydrothiophen3yl)sulfonyl)2fluorobenzamido)benzoate
MFCD10078000
ZINC000012031434
ZINC000012031440
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