Vitas-M small molecule compound
2-ethoxy-4-[(Z)-{2-[(E)-2-(4-fluorophenyl)ethenyl]-6-oxo[1,3]thiazolo[3,2-b][1,2,4]triazol-5(6H)-ylidene}methyl]phenyl acetate
Catalog ID
STK907051
SMILES CCOc1cc(ccc1OC(=O)C)/C=c/1\sc2n(c1=O)nc(n2)/C=C/c1ccc(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 C23H18FN3O4S MW 451.48 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H18FN3O4S/c1-3-30-19-12-16(6-10-18(19)31-14(2)28)13-20-22(29)27-23(32-20)25-21(26-27)11-7-15-4-8-17(24)9-5-15/h4-13H,3H2,1-2H3/b11-7+,20-13-InChIKey
NKUSELGLOMEUDK-KZBAPLJJSA-NSynonyms
(2ethoxy4((Z)(2((E)2(4fluorophenyl)ethenyl)6oxo(13)thiazolo(32b)(124)triazol5ylidene)methyl)phenyl)acetate
2ethoxy4((Z)(2((E)2(4fluorophenyl)ethenyl)6oxo(13)thiazolo(32b)(124)triazol5(6H)ylidene)methyl)phenylacetate
CCOC1=C(C=CC(=C1)C=C2C(=O)N3C(=NC(=N3)C=CC4=CC=C(C=C4)F)S2)OC(=O)C
CCOc1cc(ccc1OC(=O)C)C=c1sc2n(c1=O)nc(n2)C=Cc1ccc(cc1)F
InChI=1SC23H18FN3O4Sc1330191216(61018(19)3114(2)28)132022(29)2723(3220)2521(2627)117154817(24)9515h413H3H212H3b117+2013
MFCD18076429
ZINC000027023186
ZINC27023186
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