Vitas-M small molecule compound
(5E)-5-(2-methoxybenzylidene)-2-[4-(2-methylpropoxy)phenyl][1,3]thiazolo[3,2-b][1,2,4]triazol-6(5H)-one
Catalog ID
STK812367
SMILES COc1ccccc1/C=c\1/sc2n(c1=O)nc(n2)c1ccc(cc1)OCC(C)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 C22H21N3O3S MW 407.49 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H21N3O3S/c1-14(2)13-28-17-10-8-15(9-11-17)20-23-22-25(24-20)21(26)19(29-22)12-16-6-4-5-7-18(16)27-3/h4-12,14H,13H2,1-3H3/b19-12+InChIKey
RMNVUWFDNCVLLD-XDHOZWIPSA-NSynonyms
(5E)5((2methoxyphenyl)methylidene)2(4(2methylpropoxy)phenyl)(13)thiazolo(32b)(124)triazol6one
(5E)5(2methoxybenzylidene)2(4(2methylpropoxy)phenyl)(13)thiazolo(32b)(124)triazol6(5H)one
CC(C)COC1=CC=C(C=C1)C2=NN3C(=O)C(=CC4=CC=CC=C4OC)SC3=N2
COc1ccccc1C=c1sc2n(c1=O)nc(n2)c1ccc(cc1)OCC(C)C
InChI=1SC22H21N3O3Sc114(2)13281710815(91117)20232225(2420)21(26)19(2922)1216645718(16)273h41214H13H213H3b1912+
MFCD04445824
ZINC000016728869
ZINC16728869
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