Vitas-M small molecule compound
(5Z)-5-(4-ethoxy-3-methoxybenzylidene)-2-[4-(pentyloxy)phenyl][1,3]thiazolo[3,2-b][1,2,4]triazol-6(5H)-one
Catalog ID
STK817413
SMILES CCCCCOc1ccc(cc1)c1nc2n(n1)c(=O)/c(=C/c1ccc(c(c1)OC)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 C25H27N3O4S MW 465.57 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H27N3O4S/c1-4-6-7-14-32-19-11-9-18(10-12-19)23-26-25-28(27-23)24(29)22(33-25)16-17-8-13-20(31-5-2)21(15-17)30-3/h8-13,15-16H,4-7,14H2,1-3H3/b22-16-InChIKey
DZGUXOTYUJDSTQ-JWGURIENSA-NSynonyms
(5Z)5((4ETHOXY3METHOXYPHENYL)METHYLIDENE)2(4PENTOXYPHENYL)(13)THIAZOLO(32B)(124)TRIAZOL6ONE
(5Z)5(4ethoxy3methoxybenzylidene)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)OC)SC3=N2
CCCCCOc1ccc(cc1)c1nc2n(n1)c(=O)c(=Cc1ccc(c(c1)OC)OCC)s2
InChI=1SC25H27N3O4Sc146714321911918(101219)23262528(2723)24(29)22(3325)161781320(3152)21(1517)303h8131516H4714H213H3b2216
MFCD06642975
ZINC000003650906
ZINC03650906
ZINC3650906
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