Vitas-M small molecule compound

(5Z)-2-[(E)-2-(4-chlorophenyl)ethenyl]-5-(2-methoxybenzylidene)[1,3]thiazolo[3,2-b][1,2,4]triazol-6(5H)-one

Catalog ID
STK799465
SMILES COc1ccccc1/C=c/1\sc2n(c1=O)nc(n2)/C=C/c1ccc(cc1)Cl

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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 C20H14ClN3O2S MW 395.87 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H14ClN3O2S/c1-26-16-5-3-2-4-14(16)12-17-19(25)24-20(27-17)22-18(23-24)11-8-13-6-9-15(21)10-7-13/h2-12H,1H3/b11-8+,17-12-
InChIKey
SMAOQCGFRNAGQR-JUBDITTISA-N
Synonyms
7066-62-8
(5Z)2((E)2(4chlorophenyl)ethenyl)5((2methoxyphenyl)methylidene)(13)thiazolo(32b)(124)triazol6one
(5Z)2((E)2(4chlorophenyl)ethenyl)5(2methoxybenzylidene)(13)thiazolo(32b)(124)triazol6(5H)one
7066628
COC1=CC=CC=C1C=C2C(=O)N3C(=NC(=N3)C=CC4=CC=C(C=C4)Cl)S2
COc1ccccc1C=c1sc2n(c1=O)nc(n2)C=Cc1ccc(cc1)Cl
InChI=1SC20H14ClN3O2Sc12616532414(16)121719(25)2420(2717)2218(2324)118136915(21)10713h212H1H3b118+1712
MFCD04446921
ZINC000016734957
ZINC16734957

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Available files

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