Vitas-M small molecule compound
(5Z)-2-(4-butoxyphenyl)-5-[(1,3-diphenyl-1H-pyrazol-4-yl)methylidene][1,3]thiazolo[3,2-b][1,2,4]triazol-6(5H)-one
Catalog ID
STK815929
SMILES CCCCOc1ccc(cc1)c1nn2c(n1)s/c(=C\c1cn(nc1c1ccccc1)c1ccccc1)/c2=O
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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 C30H25N5O2S MW 519.63 g/mol Purity >90% as per NMR
InChI
InChI=1S/C30H25N5O2S/c1-2-3-18-37-25-16-14-22(15-17-25)28-31-30-35(33-28)29(36)26(38-30)19-23-20-34(24-12-8-5-9-13-24)32-27(23)21-10-6-4-7-11-21/h4-17,19-20H,2-3,18H2,1H3/b26-19-InChIKey
LYCFYVNQIXXNSZ-XHPQRKPJSA-NSynonyms
(5Z)2(4butoxyphenyl)5((13diphenyl1Hpyrazol4yl)methylidene)(13)thiazolo(32b)(124)triazol6(5H)one
(5Z)2(4BUTOXYPHENYL)5((13DIPHENYLPYRAZOL4YL)METHYLIDENE)(13)THIAZOLO(32B)(124)TRIAZOL6ONE
CCCCOC1=CC=C(C=C1)C2=NN3C(=O)C(=CC4=CN(N=C4C5=CC=CC=C5)C6=CC=CC=C6)SC3=N2
CCCCOc1ccc(cc1)c1nn2c(n1)sc(=Cc1cn(nc1c1ccccc1)c1ccccc1)c2=O
InChI=1SC30H25N5O2Sc123183725161422(151725)28313035(3328)29(36)26(3830)19232034(24128591324)3227(23)21106471121h4171920H2318H21H3b2619
MFCD03497660
ZINC000016732923
ZINC16732923
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