Vitas-M small molecule compound

(5Z)-5-(4-methylbenzylidene)-2-[4-(pentyloxy)phenyl][1,3]thiazolo[3,2-b][1,2,4]triazol-6(5H)-one

Catalog ID
STK817505
SMILES CCCCCOc1ccc(cc1)c1nn2c(n1)s/c(=C\c1ccc(cc1)C)/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 C23H23N3O2S MW 405.52 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H23N3O2S/c1-3-4-5-14-28-19-12-10-18(11-13-19)21-24-23-26(25-21)22(27)20(29-23)15-17-8-6-16(2)7-9-17/h6-13,15H,3-5,14H2,1-2H3/b20-15-
InChIKey
SFWZEVCHKNBONW-HKWRFOASSA-N
Synonyms

(5Z)5((4METHYLPHENYL)METHYLIDENE)2(4PENTOXYPHENYL)(13)THIAZOLO(32B)(124)TRIAZOL6ONE
(5Z)5(4methylbenzylidene)2(4(pentyloxy)phenyl)(13)thiazolo(32b)(124)triazol6(5H)one
CCCCCOC1=CC=C(C=C1)C2=NN3C(=O)C(=CC4=CC=C(C=C4)C)SC3=N2
CCCCCOc1ccc(cc1)c1nn2c(n1)sc(=Cc1ccc(cc1)C)c2=O
InChI=1SC23H23N3O2Sc1345142819121018(111319)21242326(2521)22(27)20(2923)15178616(2)7917h61315H3514H212H3b2015
MFCD06308805
ZINC000003648980
ZINC03648980
ZINC3648980

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Available files

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