Vitas-M small molecule compound

(2E)-2-(4-ethoxy-3-methoxybenzylidene)-6-(4-fluorobenzyl)-7H-[1,3]thiazolo[3,2-b][1,2,4]triazine-3,7(2H)-dione

Catalog ID
STK704533
SMILES CCOc1ccc(cc1OC)/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 C22H18FN3O4S MW 439.47 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H18FN3O4S/c1-3-30-17-9-6-14(11-18(17)29-2)12-19-21(28)26-22(31-19)24-20(27)16(25-26)10-13-4-7-15(23)8-5-13/h4-9,11-12H,3,10H2,1-2H3/b19-12+
InChIKey
LXWTUJFFEIUZHZ-XDHOZWIPSA-N
Synonyms

(2E)2((4ETHOXY3METHOXYPHENYL)METHYLIDENE)6((4FLUOROPHENYL)METHYL)(13)THIAZOLO(32B)(124)TRIAZINE37DIONE
(2E)2(4ethoxy3methoxybenzylidene)6(4fluorobenzyl)7H(13)thiazolo(32b)(124)triazine37(2H)dione
(Z)2(4ethoxy3methoxybenzylidene)6(4fluorobenzyl)2Hthiazolo(32b)(124)triazine37dione
CCOC1=C(C=C(C=C1)C=C2C(=O)N3C(=NC(=O)C(=N3)CC4=CC=C(C=C4)F)S2)OC
CCOc1ccc(cc1OC)C=c1sc2n(c1=O)nc(c(=O)n2)Cc1ccc(cc1)F
InChI=1SC22H18FN3O4Sc1330179614(1118(17)292)121921(28)2622(3119)2420(27)16(2526)10134715(23)8513h491112H310H212H3b1912+
MFCD04446559
ZINC000026533964
ZINC26533964

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Available files

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