Vitas-M small molecule compound
(5E)-5-(4-butoxybenzylidene)-2-(4-ethoxyphenyl)[1,3]thiazolo[3,2-b][1,2,4]triazol-6(5H)-one
Catalog ID
STK814166
SMILES CCCCOc1ccc(cc1)/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 C23H23N3O3S MW 421.52 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H23N3O3S/c1-3-5-14-29-19-10-6-16(7-11-19)15-20-22(27)26-23(30-20)24-21(25-26)17-8-12-18(13-9-17)28-4-2/h6-13,15H,3-5,14H2,1-2H3/b20-15+InChIKey
VBHWAUJMQLUGJP-HMMYKYKNSA-NSynonyms
606954-99-8(5E)5((4BUTOXYPHENYL)METHYLIDENE)2(4ETHOXYPHENYL)(13)THIAZOLO(32B)(124)TRIAZOL6ONE
(5E)5(4butoxybenzylidene)2(4ethoxyphenyl)(13)thiazolo(32b)(124)triazol6(5H)one
5(4BUTOXYBENZYLIDENE)2(4ETHOXYPHENYL)THIAZOLO(32B)(124)TRIAZOL6(5H)ONE
606954998
CCCCOC1=CC=C(C=C1)C=C2C(=O)N3C(=NC(=N3)C4=CC=C(C=C4)OCC)S2
CCCCOc1ccc(cc1)C=c1sc2n(c1=O)nc(n2)c1ccc(cc1)OCC
InChI=1SC23H23N3O3Sc13514291910616(71119)152022(27)2623(3020)2421(2526)1781218(13917)2842h61315H3514H212H3b2015+
MFCD04442015
ZINC000002533446
ZINC02533446
ZINC2533446
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