Vitas-M small molecule compound
(5E)-5-[(2E)-3-(2-methoxyphenyl)prop-2-en-1-ylidene]-2-(3-methylphenyl)[1,3]thiazolo[3,2-b][1,2,4]triazol-6(5H)-one
Catalog ID
STK704214
SMILES COc1ccccc1/C=C/C=c\1/sc2n(c1=O)nc(n2)c1cccc(c1)C
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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 C21H17N3O2S MW 375.45 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H17N3O2S/c1-14-7-5-10-16(13-14)19-22-21-24(23-19)20(25)18(27-21)12-6-9-15-8-3-4-11-17(15)26-2/h3-13H,1-2H3/b9-6+,18-12+InChIKey
ROTZRHWZHSEBHA-PXYULHTISA-NSynonyms
(5E)5((2E)3(2methoxyphenyl)prop2en1ylidene)2(3methylphenyl)(13)thiazolo(32b)(124)triazol6(5H)one
(5E)5((E)3(2METHOXYPHENYL)PROP2ENYLIDENE)2(3METHYLPHENYL)(13)THIAZOLO(32B)(124)TRIAZOL6ONE
(Z)5((E)3(2methoxyphenyl)allylidene)2(mtolyl)thiazolo(32b)(124)triazol6(5H)one
CC1=CC=CC(=C1)C2=NN3C(=O)C(=CC=CC4=CC=CC=C4OC)SC3=N2
COc1ccccc1C=CC=c1sc2n(c1=O)nc(n2)c1cccc(c1)C
InChI=1SC21H17N3O2Sc114751016(1314)19222124(2319)20(25)18(2721)1269158341117(15)262h313H12H3b96+1812+
MFCD04446444
ZINC000006479011
ZINC06479011
ZINC6479011
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