Vitas-M small molecule compound
methyl 2-({1,1,1,3,3,3-hexafluoro-2-[(pyridin-4-ylcarbonyl)amino]propan-2-yl}amino)-5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophene-3-carboxylate
Catalog ID
STK762841
SMILES COC(=O)c1c(sc2c1CCCCC2)NC(C(F)(F)F)(C(F)(F)F)NC(=O)c1ccncc1
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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 C20H19F6N3O3S MW 495.45 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H19F6N3O3S/c1-32-17(31)14-12-5-3-2-4-6-13(12)33-16(14)29-18(19(21,22)23,20(24,25)26)28-15(30)11-7-9-27-10-8-11/h7-10,29H,2-6H2,1H3,(H,28,30)InChIKey
HPVGIGUZMWKFIY-UHFFFAOYSA-NSynonyms
299922-93-3299922933
COC(=O)C1=C(SC2=C1CCCCC2)NC(C(F)(F)F)(C(F)(F)F)NC(=O)C3=CC=NC=C3
InChI=1SC20H19F6N3O3Sc13217(31)14125324613(12)3316(14)2918(19(2122)2320(2425)26)2815(30)11792710811h71029H26H21H3(H2830)
methyl2((111333hexafluoro2((pyridin4ylcarbonyl)amino)propan2yl)amino)5678tetrahydro4Hcyclohepta(b)thiophene3carboxylate
methyl2((111333hexafluoro2(isonicotinamido)propan2yl)amino)5678tetrahydro4Hcyclohepta(b)thiophene3carboxylate
methyl2((111333hexafluoro2(pyridine4carbonylamino)propan2yl)amino)5678tetrahydro4Hcyclohepta(b)thiophene3carboxylate
MFCD01959711
ZINC000000721283
ZINC00721283
ZINC721283
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