Vitas-M small molecule compound

(5E)-2-(4-bromophenyl)-5-[(2E)-3-(2-methoxyphenyl)prop-2-en-1-ylidene][1,3]thiazolo[3,2-b][1,2,4]triazol-6(5H)-one

Catalog ID
STK814160
SMILES COc1ccccc1/C=C/C=c\1/sc2n(c1=O)nc(n2)c1ccc(cc1)Br

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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 C20H14BrN3O2S MW 440.32 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H14BrN3O2S/c1-26-16-7-3-2-5-13(16)6-4-8-17-19(25)24-20(27-17)22-18(23-24)14-9-11-15(21)12-10-14/h2-12H,1H3/b6-4+,17-8+
InChIKey
ZOKKBAUCRVXIMO-MLIFEPNPSA-N
Synonyms

(5E)2(4bromophenyl)5((2E)3(2methoxyphenyl)prop2en1ylidene)(13)thiazolo(32b)(124)triazol6(5H)one
(5E)2(4bromophenyl)5((E)3(2methoxyphenyl)prop2enylidene)(13)thiazolo(32b)(124)triazol6one
COC1=CC=CC=C1C=CC=C2C(=O)N3C(=NC(=N3)C4=CC=C(C=C4)Br)S2
COc1ccccc1C=CC=c1sc2n(c1=O)nc(n2)c1ccc(cc1)Br
InChI=1SC20H14BrN3O2Sc12616732513(16)6481719(25)2420(2717)2218(2324)1491115(21)121014h212H1H3b64+178+
MFCD04442011
ZINC000016730806
ZINC16730806

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Available files

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