Vitas-M small molecule compound
(2E)-6-(4-methylbenzyl)-2-[4-(3-methylbutoxy)benzylidene]-7H-[1,3]thiazolo[3,2-b][1,2,4]triazine-3,7(2H)-dione
Catalog ID
STK706586
SMILES CC(CCOc1ccc(cc1)/C=c\1/sc2n(c1=O)nc(c(=O)n2)Cc1ccc(cc1)C)C
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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 C25H25N3O3S MW 447.56 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H25N3O3S/c1-16(2)12-13-31-20-10-8-19(9-11-20)15-22-24(30)28-25(32-22)26-23(29)21(27-28)14-18-6-4-17(3)5-7-18/h4-11,15-16H,12-14H2,1-3H3/b22-15+InChIKey
NECBYZHNVWELID-PXLXIMEGSA-NSynonyms
(2E)2((4(3METHYLBUTOXY)PHENYL)METHYLIDENE)6((4METHYLPHENYL)METHYL)(13)THIAZOLO(32B)(124)TRIAZINE37DIONE
(2E)6(4methylbenzyl)2(4(3methylbutoxy)benzylidene)7H(13)thiazolo(32b)(124)triazine37(2H)dione
(Z)2(4(isopentyloxy)benzylidene)6(4methylbenzyl)2Hthiazolo(32b)(124)triazine37dione
CC(CCOc1ccc(cc1)C=c1sc2n(c1=O)nc(c(=O)n2)Cc1ccc(cc1)C)C
CC1=CC=C(C=C1)CC2=NN3C(=O)C(=CC4=CC=C(C=C4)OCCC(C)C)SC3=NC2=O
InChI=1SC25H25N3O3Sc116(2)1213312010819(91120)152224(30)2825(3222)2623(29)21(2728)14186417(3)5718h4111516H1214H213H3b2215+
MFCD06290991
ZINC000026458837
ZINC26458837
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