Vitas-M small molecule compound

(7Z)-7-[(2E)-3-phenylprop-2-en-1-ylidene]-3-[3-(trifluoromethyl)phenyl]-3,4-dihydro-2H-[1,3]thiazolo[3,2-a][1,3,5]triazin-6(7H)-one

Catalog ID
STK724962
SMILES O=c1/c(=C/C=C/c2ccccc2)/sc2=NCN(Cn12)c1cccc(c1)C(F)(F)F

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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 C21H16F3N3OS MW 415.44 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H16F3N3OS/c22-21(23,24)16-9-5-10-17(12-16)26-13-25-20-27(14-26)19(28)18(29-20)11-4-8-15-6-2-1-3-7-15/h1-12H,13-14H2/b8-4+,18-11-
InChIKey
UFJXJVICUMBGDU-KGTQDBRDSA-N
Synonyms
799834-40-5
(7Z)7((2E)3phenylprop2en1ylidene)3(3(trifluoromethyl)phenyl)34dihydro2H(13)thiazolo(32a)(135)triazin6(7H)one
(7Z)7((E)3PHENYLPROP2ENYLIDENE)3(3(TRIFLUOROMETHYL)PHENYL)24DIHYDRO(13)THIAZOLO(32A)(135)TRIAZIN6ONE
(Z)7((E)3phenylallylidene)3(3(trifluoromethyl)phenyl)34dihydro2Hthiazolo(32a)(135)triazin6(7H)one
799834405
C1N=C2N(CN1C3=CC=CC(=C3)C(F)(F)F)C(=O)C(=CC=CC4=CC=CC=C4)S2
InChI=1SC21H16F3N3OSc2221(2324)16951017(1216)2613252027(1426)19(28)18(2920)1148156213715h112H1314H2b84+1811
MFCD03684964
O=c1c(=CC=Cc2ccccc2)sc2=NCN(Cn12)c1cccc(c1)C(F)(F)F
ZINC000002246596
ZINC02246596
ZINC2246596

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Available files

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