Vitas-M small molecule compound
methyl 3-[({1-[(4-fluorobenzyl)sulfonyl]piperidin-3-yl}carbonyl)amino]-2-methylbenzoate
Catalog ID
STL385148
SMILES COC(=O)c1cccc(c1C)NC(=O)C1CCCN(C1)S(=O)(=O)Cc1ccc(cc1)F
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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 C22H25FN2O5S MW 448.52 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H25FN2O5S/c1-15-19(22(27)30-2)6-3-7-20(15)24-21(26)17-5-4-12-25(13-17)31(28,29)14-16-8-10-18(23)11-9-16/h3,6-11,17H,4-5,12-14H2,1-2H3,(H,24,26)InChIKey
TZQXXIYLLVRIHF-UHFFFAOYSA-NSynonyms
CC1=C(C=CC=C1NC(=O)C2CCCN(C2)S(=O)(=O)CC3=CC=C(C=C3)F)C(=O)OC
InChI=1SC22H25FN2O5Sc11519(22(27)302)63720(15)2421(26)17541225(1317)31(2829)141681018(23)11916h361117H451214H212H3(H2426)
methyl3(((1((4fluorobenzyl)sulfonyl)piperidin3yl)carbonyl)amino)2methylbenzoate
methyl3((1((4fluorophenyl)methylsulfonyl)piperidine3carbonyl)amino)2methylbenzoate
MFCD27216600
ZINC000019863054
ZINC000019863056
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