Vitas-M small molecule compound

(2Z)-6-(4-methoxybenzyl)-2-({5-[3-(trifluoromethyl)phenyl]furan-2-yl}methylidene)-7H-[1,3]thiazolo[3,2-b][1,2,4]triazine-3,7(2H)-dione

Catalog ID
STK904516
SMILES COc1ccc(cc1)Cc1nn2c(nc1=O)s/c(=C\c1ccc(o1)c1cccc(c1)C(F)(F)F)/c2=O

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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 C25H16F3N3O4S MW 511.48 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H16F3N3O4S/c1-34-17-7-5-14(6-8-17)11-19-22(32)29-24-31(30-19)23(33)21(36-24)13-18-9-10-20(35-18)15-3-2-4-16(12-15)25(26,27)28/h2-10,12-13H,11H2,1H3/b21-13-
InChIKey
QFGBQWCCHGZJDU-BKUYFWCQSA-N
Synonyms
840461-34-9
(2Z)6((4METHOXYPHENYL)METHYL)2((5(3(TRIFLUOROMETHYL)PHENYL)FURAN2YL)METHYLIDENE)(13)THIAZOLO(32B)(124)TRIAZINE37DIONE
(2Z)6(4methoxybenzyl)2((5(3(trifluoromethyl)phenyl)furan2yl)methylidene)7H(13)thiazolo(32b)(124)triazine37(2H)dione
(Z)6(4methoxybenzyl)2((5(3(trifluoromethyl)phenyl)furan2yl)methylene)2Hthiazolo(32b)(124)triazine37dione
840461349
COC1=CC=C(C=C1)CC2=NN3C(=O)C(=CC4=CC=C(O4)C5=CC(=CC=C5)C(F)(F)F)SC3=NC2=O
COc1ccc(cc1)Cc1nn2c(nc1=O)sc(=Cc1ccc(o1)c1cccc(c1)C(F)(F)F)c2=O
InChI=1SC25H16F3N3O4Sc134177514(6817)111922(32)292431(3019)23(33)21(3624)131891020(3518)1532416(1215)25(2627)28h2101213H11H21H3b2113
MFCD03695278
ZINC000002258069
ZINC02258069
ZINC2258069

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.