Vitas-M small molecule compound
(5Z)-5-(3,4-diethoxybenzylidene)-2-[4-(pentyloxy)phenyl][1,3]thiazolo[3,2-b][1,2,4]triazol-6(5H)-one
Catalog ID
STK817408
SMILES CCCCCOc1ccc(cc1)c1nc2n(n1)c(=O)/c(=C/c1ccc(c(c1)OCC)OCC)/s2
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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 C26H29N3O4S MW 479.60 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H29N3O4S/c1-4-7-8-15-33-20-12-10-19(11-13-20)24-27-26-29(28-24)25(30)23(34-26)17-18-9-14-21(31-5-2)22(16-18)32-6-3/h9-14,16-17H,4-8,15H2,1-3H3/b23-17-InChIKey
NAKLCEHTOJRTIV-QJOMJCCJSA-NSynonyms
(5Z)5((34DIETHOXYPHENYL)METHYLIDENE)2(4PENTOXYPHENYL)(13)THIAZOLO(32B)(124)TRIAZOL6ONE
(5Z)5(34diethoxybenzylidene)2(4(pentyloxy)phenyl)(13)thiazolo(32b)(124)triazol6(5H)one
CCCCCOC1=CC=C(C=C1)C2=NN3C(=O)C(=CC4=CC(=C(C=C4)OCC)OCC)SC3=N2
CCCCCOc1ccc(cc1)c1nc2n(n1)c(=O)c(=Cc1ccc(c(c1)OCC)OCC)s2
InChI=1SC26H29N3O4Sc1478153320121019(111320)24272629(2824)25(30)23(3426)171891421(3152)22(1618)3263h9141617H4815H213H3b2317
MFCD06642973
ZINC000003650930
ZINC03650930
ZINC3650930
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