Vitas-M small molecule compound

N-(1,1,1,3,3,3-hexafluoro-2-{2-[(furan-2-ylmethyl)amino]-4,4-dimethyl-6-oxocyclohex-1-en-1-yl}propan-2-yl)thiophene-2-carboxamide

Catalog ID
STL343739
SMILES O=C(c1cccs1)NC(C(F)(F)F)(C(F)(F)F)C1=C(NCc2ccco2)CC(CC1=O)(C)C

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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 C21H20F6N2O3S MW 494.46 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H20F6N2O3S/c1-18(2)9-13(28-11-12-5-3-7-32-12)16(14(30)10-18)19(20(22,23)24,21(25,26)27)29-17(31)15-6-4-8-33-15/h3-8,28H,9-11H2,1-2H3,(H,29,31)
InChIKey
CPYLIYAWTOBEGL-UHFFFAOYSA-N
Synonyms
845668-50-0
845668500
CC1(CC(=C(C(=O)C1)C(C(F)(F)F)(C(F)(F)F)NC(=O)C2=CC=CS2)NCC3=CC=CO3)C
InChI=1SC21H20F6N2O3Sc118(2)913(2811125373212)16(14(30)1018)19(20(2223)2421(2526)27)2917(31)156483315h3828H911H212H3(H2931)
MFCD04169346
N(111333hexafluoro2(2((furan2ylmethyl)amino)44dimethyl6oxocyclohex1en1yl)propan2yl)thiophene2carboxamide
N(111333hexafluoro2(2(furan2ylmethylamino)44dimethyl6oxocyclohexen1yl)propan2yl)thiophene2carboxamide
ZINC000101116684
ZINC101116684

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Available files

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