Vitas-M small molecule compound

(5Z)-2-(4-butoxyphenyl)-5-{[5-(3-chlorophenyl)furan-2-yl]methylidene}[1,3]thiazolo[3,2-b][1,2,4]triazol-6(5H)-one

Catalog ID
STK706658
SMILES CCCCOc1ccc(cc1)c1nn2c(n1)s/c(=C\c1ccc(o1)c1cccc(c1)Cl)/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 C25H20ClN3O3S MW 477.97 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H20ClN3O3S/c1-2-3-13-31-19-9-7-16(8-10-19)23-27-25-29(28-23)24(30)22(33-25)15-20-11-12-21(32-20)17-5-4-6-18(26)14-17/h4-12,14-15H,2-3,13H2,1H3/b22-15-
InChIKey
OETYELPYBOQCQY-JCMHNJIXSA-N
Synonyms
606952-16-3
(5Z)2(4butoxyphenyl)5((5(3chlorophenyl)furan2yl)methylidene)(13)thiazolo(32b)(124)triazol6(5H)one
(5Z)2(4BUTOXYPHENYL)5((5(3CHLOROPHENYL)FURAN2YL)METHYLIDENE)(13)THIAZOLO(32B)(124)TRIAZOL6ONE
(Z)2(4butoxyphenyl)5((5(3chlorophenyl)furan2yl)methylene)thiazolo(32b)(124)triazol6(5H)one
606952163
CCCCOC1=CC=C(C=C1)C2=NN3C(=O)C(=CC4=CC=C(O4)C5=CC(=CC=C5)Cl)SC3=N2
CCCCOc1ccc(cc1)c1nn2c(n1)sc(=Cc1ccc(o1)c1cccc(c1)Cl)c2=O
InChI=1SC25H20ClN3O3Sc1231331199716(81019)23272529(2823)24(30)22(3325)1520111221(3220)1754618(26)1417h4121415H2313H21H3b2215
MFCD03532745
ZINC000002263208
ZINC02263208
ZINC2263208

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Available files

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