Vitas-M small molecule compound
3'-(2-fluorophenyl)-5'-hydroxy-1-methyl-2-oxo-5-(propan-2-yl)-1,2-dihydro-6'H-spiro[indole-3,7'-thieno[3,2-b]pyridine]-2'-carboxylic acid
Catalog ID
STK660258
SMILES OC1=Nc2c(c(sc2C2(C1)C(=O)N(c1c2cc(cc1)C(C)C)C)C(=O)O)c1ccccc1F
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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 C25H21FN2O4S MW 464.52 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H21FN2O4S/c1-12(2)13-8-9-17-15(10-13)25(24(32)28(17)3)11-18(29)27-20-19(14-6-4-5-7-16(14)26)21(23(30)31)33-22(20)25/h4-10,12H,11H2,1-3H3,(H,27,29)(H,30,31)InChIKey
HVUBBMPBKQISHF-UHFFFAOYSA-NSynonyms
1190286-46-41190286464
3(2fluorophenyl)1methyl25dioxo5propan2ylspiro(46dihydrothieno(32b)pyridine73indole)2carboxylicacid
3(2fluorophenyl)5hydroxy1methyl2oxo5(propan2yl)12dihydro6Hspiro(indole37thieno(32b)pyridine)2carboxylicacid
CC(C)C1=CC2=C(C=C1)N(C(=O)C23CC(=O)NC4=C3SC(=C4C5=CC=CC=C5F)C(=O)O)C
InChI=1SC25H21FN2O4Sc112(2)13891715(1013)25(24(32)28(17)3)1118(29)272019(14645716(14)26)21(23(30)31)3322(20)25h41012H11H213H3(H2729)(H3031)
MFCD18168997
ZINC000036358051
ZINC000036358052
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