Vitas-M small molecule compound

(2Z)-6-(4-fluorobenzyl)-2-[3-methoxy-4-(3-methylbutoxy)benzylidene]-7H-[1,3]thiazolo[3,2-b][1,2,4]triazine-3,7(2H)-dione

Catalog ID
STK705674
SMILES COc1cc(ccc1OCCC(C)C)/C=c/1\sc2n(c1=O)nc(c(=O)n2)Cc1ccc(cc1)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 C25H24FN3O4S MW 481.55 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H24FN3O4S/c1-15(2)10-11-33-20-9-6-17(13-21(20)32-3)14-22-24(31)29-25(34-22)27-23(30)19(28-29)12-16-4-7-18(26)8-5-16/h4-9,13-15H,10-12H2,1-3H3/b22-14-
InChIKey
ZTYHWHDFJODOHD-HMAPJEAMSA-N
Synonyms
620539-67-5
(2Z)6((4FLUOROPHENYL)METHYL)2((3METHOXY4(3METHYLBUTOXY)PHENYL)METHYLIDENE)(13)THIAZOLO(32B)(124)TRIAZINE37DIONE
(2Z)6(4fluorobenzyl)2(3methoxy4(3methylbutoxy)benzylidene)7H(13)thiazolo(32b)(124)triazine37(2H)dione
(Z)6(4fluorobenzyl)2(4(isopentyloxy)3methoxybenzylidene)2Hthiazolo(32b)(124)triazine37dione
620539675
CC(C)CCOC1=C(C=C(C=C1)C=C2C(=O)N3C(=NC(=O)C(=N3)CC4=CC=C(C=C4)F)S2)OC
COc1cc(ccc1OCCC(C)C)C=c1sc2n(c1=O)nc(c(=O)n2)Cc1ccc(cc1)F
InChI=1SC25H24FN3O4Sc115(2)101133209617(1321(20)323)142224(31)2925(3422)2723(30)19(2829)12164718(26)8516h491315H1012H213H3b2214
MFCD04171517
ZINC000002419135
ZINC02419135
ZINC2419135

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Available files

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