Vitas-M small molecule compound

(7Z)-7-(5-ethoxy-2-oxo-1,2-dihydro-3H-indol-3-ylidene)-3-[3-(trifluoromethyl)phenyl]-3,4-dihydro-2H-[1,3]thiazolo[3,2-a][1,3,5]triazin-6(7H)-one

Catalog ID
STK859873
SMILES CCOc1ccc2c(c1)/C(=c\1/sc3=NCN(Cn3c1=O)c1cccc(c1)C(F)(F)F)/C(=O)N2

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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 C22H17F3N4O3S MW 474.46 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H17F3N4O3S/c1-2-32-14-6-7-16-15(9-14)17(19(30)27-16)18-20(31)29-11-28(10-26-21(29)33-18)13-5-3-4-12(8-13)22(23,24)25/h3-9H,2,10-11H2,1H3,(H,27,30)/b18-17-
InChIKey
BYGMVLRSOQAHQK-ZCXUNETKSA-N
Synonyms
799835-96-4
(7Z)7(5ethoxy2oxo12dihydro3Hindol3ylidene)3(3(trifluoromethyl)phenyl)34dihydro2H(13)thiazolo(32a)(135)triazin6(7H)one
(7Z)7(5ETHOXY2OXO1HINDOL3YLIDENE)3(3(TRIFLUOROMETHYL)PHENYL)24DIHYDRO(13)THIAZOLO(32A)(135)TRIAZIN6ONE
(Z)7(5ethoxy2oxoindolin3ylidene)3(3(trifluoromethyl)phenyl)34dihydro2Hthiazolo(32a)(135)triazin6(7H)one
799835964
CCOC1=CC2=C(C=C1)NC(=O)C2=C3C(=O)N4CN(CN=C4S3)C5=CC=CC(=C5)C(F)(F)F
CCOc1ccc2c(c1)C(=c1sc3=NCN(Cn3c1=O)c1cccc(c1)C(F)(F)F)C(=O)N2
InChI=1SC22H17F3N4O3Sc123214671615(914)17(19(30)2716)1820(31)291128(102621(29)3318)1353412(813)22(2324)25h39H21011H21H3(H2730)b1817
MFCD03685220
ZINC000013711836
ZINC13711836

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Available files

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