Vitas-M small molecule compound

(7Z)-7-(1-methyl-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
STK724929
SMILES O=C1N(C)c2c(/C/1=c\1/sc3=NCN(Cn3c1=O)c1cccc(c1)C(F)(F)F)cccc2

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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 C21H15F3N4O2S MW 444.44 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H15F3N4O2S/c1-26-15-8-3-2-7-14(15)16(18(26)29)17-19(30)28-11-27(10-25-20(28)31-17)13-6-4-5-12(9-13)21(22,23)24/h2-9H,10-11H2,1H3/b17-16-
InChIKey
KEXZBLRSDQJCJG-MSUUIHNZSA-N
Synonyms
840458-11-9
(7Z)7(1methyl2oxo12dihydro3Hindol3ylidene)3(3(trifluoromethyl)phenyl)34dihydro2H(13)thiazolo(32a)(135)triazin6(7H)one
(7Z)7(1METHYL2OXOINDOL3YLIDENE)3(3(TRIFLUOROMETHYL)PHENYL)24DIHYDRO(13)THIAZOLO(32A)(135)TRIAZIN6ONE
(Z)7(1methyl2oxoindolin3ylidene)3(3(trifluoromethyl)phenyl)34dihydro2Hthiazolo(32a)(135)triazin6(7H)one
840458119
CN1C2=CC=CC=C2C(=C3C(=O)N4CN(CN=C4S3)C5=CC=CC(=C5)C(F)(F)F)C1=O
InChI=1SC21H15F3N4O2Sc12615832714(15)16(18(26)29)1719(30)281127(102520(28)3117)1364512(913)21(2223)24h29H1011H21H3b1716
MFCD03694551
O=C1N(C)c2c(C1=c1sc3=NCN(Cn3c1=O)c1cccc(c1)C(F)(F)F)cccc2
ZINC000002256885
ZINC02256885
ZINC2256885

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Available files

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