Vitas-M small molecule compound
(2Z)-6-(4-fluorobenzyl)-2-[(2E)-3-(2-methoxyphenyl)prop-2-en-1-ylidene]-7H-[1,3]thiazolo[3,2-b][1,2,4]triazine-3,7(2H)-dione
Catalog ID
STK704962
SMILES COc1ccccc1/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 C22H16FN3O3S MW 421.45 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H16FN3O3S/c1-29-18-7-3-2-5-15(18)6-4-8-19-21(28)26-22(30-19)24-20(27)17(25-26)13-14-9-11-16(23)12-10-14/h2-12H,13H2,1H3/b6-4+,19-8-InChIKey
WJUZOWIDSCDBOY-AGASNCOBSA-NSynonyms
620539-77-7(2Z)6((4FLUOROPHENYL)METHYL)2((E)3(2METHOXYPHENYL)PROP2ENYLIDENE)(13)THIAZOLO(32B)(124)TRIAZINE37DIONE
(2Z)6(4fluorobenzyl)2((2E)3(2methoxyphenyl)prop2en1ylidene)7H(13)thiazolo(32b)(124)triazine37(2H)dione
(Z)6(4fluorobenzyl)2((E)3(2methoxyphenyl)allylidene)2Hthiazolo(32b)(124)triazine37dione
620539777
COC1=CC=CC=C1C=CC=C2C(=O)N3C(=NC(=O)C(=N3)CC4=CC=C(C=C4)F)S2
COc1ccccc1C=CC=c1sc2n(c1=O)nc(c(=O)n2)Cc1ccc(cc1)F
InChI=1SC22H16FN3O3Sc12918732515(18)6481921(28)2622(3019)2420(27)17(2526)131491116(23)121014h212H13H21H3b64+198
MFCD04193113
ZINC000002428395
ZINC02428395
ZINC2428395
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