Vitas-M small molecule compound
(5Z)-2-(4-butoxyphenyl)-5-[3-(3-methylbutoxy)benzylidene][1,3]thiazolo[3,2-b][1,2,4]triazol-6(5H)-one
Catalog ID
STK904983
SMILES CCCCOc1ccc(cc1)c1nc2n(n1)c(=O)/c(=C/c1cccc(c1)OCCC(C)C)/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 C26H29N3O3S MW 463.60 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H29N3O3S/c1-4-5-14-31-21-11-9-20(10-12-21)24-27-26-29(28-24)25(30)23(33-26)17-19-7-6-8-22(16-19)32-15-13-18(2)3/h6-12,16-18H,4-5,13-15H2,1-3H3/b23-17-InChIKey
FZZWECAQMLVBER-QJOMJCCJSA-NSynonyms
(5Z)2(4butoxyphenyl)5((3(3methylbutoxy)phenyl)methylidene)(13)thiazolo(32b)(124)triazol6one
(5Z)2(4butoxyphenyl)5(3(3methylbutoxy)benzylidene)(13)thiazolo(32b)(124)triazol6(5H)one
CCCCOC1=CC=C(C=C1)C2=NN3C(=O)C(=CC4=CC(=CC=C4)OCCC(C)C)SC3=N2
CCCCOc1ccc(cc1)c1nc2n(n1)c(=O)c(=Cc1cccc(c1)OCCC(C)C)s2
InChI=1SC26H29N3O3Sc14514312111920(101221)24272629(2824)25(30)23(3326)171976822(1619)32151318(2)3h6121618H451315H213H3b2317
MFCD18076200
ZINC000027022632
ZINC27022632
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