Vitas-M small molecule compound
(5Z)-5-[4-(diethylamino)benzylidene]-2-[4-(hexyloxy)phenyl][1,3]thiazolo[3,2-b][1,2,4]triazol-6(5H)-one
Catalog ID
STK818321
SMILES CCCCCCOc1ccc(cc1)c1nc2n(n1)c(=O)/c(=C/c1ccc(cc1)N(CC)CC)/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 C27H32N4O2S MW 476.64 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H32N4O2S/c1-4-7-8-9-18-33-23-16-12-21(13-17-23)25-28-27-31(29-25)26(32)24(34-27)19-20-10-14-22(15-11-20)30(5-2)6-3/h10-17,19H,4-9,18H2,1-3H3/b24-19-InChIKey
GQHGUGOEHHTSKK-CLCOLTQESA-NSynonyms
(5Z)5((4(DIETHYLAMINO)PHENYL)METHYLIDENE)2(4HEXOXYPHENYL)(13)THIAZOLO(32B)(124)TRIAZOL6ONE
(5Z)5(4(diethylamino)benzylidene)2(4(hexyloxy)phenyl)(13)thiazolo(32b)(124)triazol6(5H)one
CCCCCCOC1=CC=C(C=C1)C2=NN3C(=O)C(=CC4=CC=C(C=C4)N(CC)CC)SC3=N2
CCCCCCOc1ccc(cc1)c1nc2n(n1)c(=O)c(=Cc1ccc(cc1)N(CC)CC)s2
InChI=1SC27H32N4O2Sc14789183323161221(131723)25282731(2925)26(32)24(3427)1920101422(151120)30(52)63h101719H4918H213H3b2419
MFCD06308876
ZINC000003649163
ZINC03649163
ZINC3649163
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