Vitas-M small molecule compound
(5Z)-5-{[5-(3-chlorophenyl)furan-2-yl]methylidene}-2-(4-methoxyphenyl)[1,3]thiazolo[3,2-b][1,2,4]triazol-6(5H)-one
Catalog ID
STK816436
SMILES COc1ccc(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 C22H14ClN3O3S MW 435.89 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H14ClN3O3S/c1-28-16-7-5-13(6-8-16)20-24-22-26(25-20)21(27)19(30-22)12-17-9-10-18(29-17)14-3-2-4-15(23)11-14/h2-12H,1H3/b19-12-InChIKey
PJTMHCZKSKGFAF-UNOMPAQXSA-NSynonyms
(5Z)5((5(3chlorophenyl)furan2yl)methylidene)2(4methoxyphenyl)(13)thiazolo(32b)(124)triazol6(5H)one
(5Z)5((5(3CHLOROPHENYL)FURAN2YL)METHYLIDENE)2(4METHOXYPHENYL)(13)THIAZOLO(32B)(124)TRIAZOL6ONE
COC1=CC=C(C=C1)C2=NN3C(=O)C(=CC4=CC=C(O4)C5=CC(=CC=C5)Cl)SC3=N2
COc1ccc(cc1)c1nn2c(n1)sc(=Cc1ccc(o1)c1cccc(c1)Cl)c2=O
InChI=1SC22H14ClN3O3Sc128167513(6816)20242226(2520)21(27)19(3022)121791018(2917)1432415(23)1114h212H1H3b1912
MFCD03532742
ZINC000016733361
ZINC16733361
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