Vitas-M small molecule compound
(5Z)-5-(2,5-dimethoxybenzylidene)-2-[(E)-2-(4-methylphenyl)ethenyl][1,3]thiazolo[3,2-b][1,2,4]triazol-6(5H)-one
Catalog ID
STK800345
SMILES COc1ccc(cc1/C=c/1\sc2n(c1=O)nc(n2)/C=C/c1ccc(cc1)C)OC
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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 C22H19N3O3S MW 405.48 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H19N3O3S/c1-14-4-6-15(7-5-14)8-11-20-23-22-25(24-20)21(26)19(29-22)13-16-12-17(27-2)9-10-18(16)28-3/h4-13H,1-3H3/b11-8+,19-13-InChIKey
ICUAPDBMMBDYCR-SSZQZOOLSA-NSynonyms
(5Z)5((25DIMETHOXYPHENYL)METHYLIDENE)2((E)2(4METHYLPHENYL)ETHENYL)(13)THIAZOLO(32B)(124)TRIAZOL6ONE
(5Z)5(25dimethoxybenzylidene)2((E)2(4methylphenyl)ethenyl)(13)thiazolo(32b)(124)triazol6(5H)one
CC1=CC=C(C=C1)C=CC2=NN3C(=O)C(=CC4=C(C=CC(=C4)OC)OC)SC3=N2
COc1ccc(cc1C=c1sc2n(c1=O)nc(n2)C=Cc1ccc(cc1)C)OC
InChI=1SC22H19N3O3Sc1144615(7514)81120232225(2420)21(26)19(2922)13161217(272)91018(16)283h413H13H3b118+1913
MFCD04447094
ZINC000004318641
ZINC04318641
ZINC4318641
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