Vitas-M small molecule compound
(5Z)-2-(4-butoxyphenyl)-5-{[5-(2,3-dichlorophenyl)furan-2-yl]methylidene}[1,3]thiazolo[3,2-b][1,2,4]triazol-6(5H)-one
Catalog ID
STK904957
SMILES CCCCOc1ccc(cc1)c1nn2c(n1)s/c(=C\c1ccc(o1)c1cccc(c1Cl)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 C25H19Cl2N3O3S MW 512.42 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H19Cl2N3O3S/c1-2-3-13-32-16-9-7-15(8-10-16)23-28-25-30(29-23)24(31)21(34-25)14-17-11-12-20(33-17)18-5-4-6-19(26)22(18)27/h4-12,14H,2-3,13H2,1H3/b21-14-InChIKey
VLVJSUQWOYZMIE-STZFKDTASA-NSynonyms
(5Z)2(4butoxyphenyl)5((5(23dichlorophenyl)furan2yl)methylidene)(13)thiazolo(32b)(124)triazol6(5H)one
(5Z)2(4butoxyphenyl)5((5(23dichlorophenyl)furan2yl)methylidene)(13)thiazolo(32b)(124)triazol6one
CCCCOC1=CC=C(C=C1)C2=NN3C(=O)C(=CC4=CC=C(O4)C5=C(C(=CC=C5)Cl)Cl)SC3=N2
CCCCOc1ccc(cc1)c1nn2c(n1)sc(=Cc1ccc(o1)c1cccc(c1Cl)Cl)c2=O
InChI=1SC25H19Cl2N3O3Sc1231332169715(81016)23282530(2923)24(31)21(3425)1417111220(3317)1854619(26)22(18)27h41214H2313H21H3b2114
MFCD18076184
ZINC000027022571
ZINC27022571
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