Vitas-M small molecule compound
(5E)-5-{[5-(2-chlorophenyl)furan-2-yl]methylidene}-2-(4-ethoxyphenyl)[1,3]thiazolo[3,2-b][1,2,4]triazol-6(5H)-one
Catalog ID
STK797889
SMILES CCOc1ccc(cc1)c1nc2n(n1)c(=O)/c(=C\c1ccc(o1)c1ccccc1Cl)/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 C23H16ClN3O3S MW 449.92 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H16ClN3O3S/c1-2-29-15-9-7-14(8-10-15)21-25-23-27(26-21)22(28)20(31-23)13-16-11-12-19(30-16)17-5-3-4-6-18(17)24/h3-13H,2H2,1H3/b20-13+InChIKey
PGICWMAQYOLGFS-DEDYPNTBSA-NSynonyms
(5E)5((5(2chlorophenyl)furan2yl)methylidene)2(4ethoxyphenyl)(13)thiazolo(32b)(124)triazol6(5H)one
(5E)5((5(2CHLOROPHENYL)FURAN2YL)METHYLIDENE)2(4ETHOXYPHENYL)(13)THIAZOLO(32B)(124)TRIAZOL6ONE
CCOC1=CC=C(C=C1)C2=NN3C(=O)C(=CC4=CC=C(O4)C5=CC=CC=C5Cl)SC3=N2
CCOc1ccc(cc1)c1nc2n(n1)c(=O)c(=Cc1ccc(o1)c1ccccc1Cl)s2
InChI=1SC23H16ClN3O3Sc1229159714(81015)21252327(2621)22(28)20(3123)1316111219(3016)17534618(17)24h313H2H21H3b2013+
MFCD03461799
ZINC000016700039
ZINC16700039
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