Vitas-M small molecule compound
methyl 1-({[5-(1-benzofuran-2-yl)-4-phenyl-4H-1,2,4-triazol-3-yl]sulfanyl}acetyl)piperidine-4-carboxylate
Catalog ID
STL365346
SMILES COC(=O)C1CCN(CC1)C(=O)CSc1nnc(n1c1ccccc1)c1cc2c(o1)cccc2
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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 C25H24N4O4S MW 476.56 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H24N4O4S/c1-32-24(31)17-11-13-28(14-12-17)22(30)16-34-25-27-26-23(29(25)19-8-3-2-4-9-19)21-15-18-7-5-6-10-20(18)33-21/h2-10,15,17H,11-14,16H2,1H3InChIKey
QQYFFHNQGFFPNG-UHFFFAOYSA-NSynonyms
COC(=O)C1CCN(CC1)C(=O)CSC2=NN=C(N2C3=CC=CC=C3)C4=CC5=CC=CC=C5O4
InChI=1SC25H24N4O4Sc13224(31)17111328(141217)22(30)163425272623(29(25)198324919)2115187561020(18)3321h2101517H111416H21H3
methyl1(((5(1benzofuran2yl)4phenyl4H124triazol3yl)sulfanyl)acetyl)piperidine4carboxylate
methyl1(2((5(1benzofuran2yl)4phenyl124triazol3yl)sulfanyl)acetyl)piperidine4carboxylate
MFCD09476105
ZINC000015018889
ZINC15018889
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