Vitas-M small molecule compound
(5E)-5-(4-butoxy-3-methoxybenzylidene)-2-(4-ethoxyphenyl)[1,3]thiazolo[3,2-b][1,2,4]triazol-6(5H)-one
Catalog ID
STK814759
SMILES CCCCOc1ccc(cc1OC)/C=c\1/sc2n(c1=O)nc(n2)c1ccc(cc1)OCC
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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 C24H25N3O4S MW 451.55 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H25N3O4S/c1-4-6-13-31-19-12-7-16(14-20(19)29-3)15-21-23(28)27-24(32-21)25-22(26-27)17-8-10-18(11-9-17)30-5-2/h7-12,14-15H,4-6,13H2,1-3H3/b21-15+InChIKey
QPURNTBJKFLQOO-RCCKNPSSSA-NSynonyms
(5E)5((4BUTOXY3METHOXYPHENYL)METHYLIDENE)2(4ETHOXYPHENYL)(13)THIAZOLO(32B)(124)TRIAZOL6ONE
(5E)5(4butoxy3methoxybenzylidene)2(4ethoxyphenyl)(13)thiazolo(32b)(124)triazol6(5H)one
CCCCOC1=C(C=C(C=C1)C=C2C(=O)N3C(=NC(=N3)C4=CC=C(C=C4)OCC)S2)OC
CCCCOc1ccc(cc1OC)C=c1sc2n(c1=O)nc(n2)c1ccc(cc1)OCC
InChI=1SC24H25N3O4Sc14613311912716(1420(19)293)152123(28)2724(3221)2522(2627)1781018(11917)3052h7121415H4613H213H3b2115+
MFCD04442307
ZINC000002533668
ZINC02533668
ZINC2533668
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