Vitas-M small molecule compound
5-(2,6-dimethylmorpholin-4-yl)-2-{(E)-[3-(4-fluorobenzyl)-4-oxo-2-thioxo-1,3-thiazolidin-5-ylidene]methyl}-1,3-oxazole-4-carbonitrile
Catalog ID
STK905996
SMILES N#Cc1nc(oc1N1CC(C)OC(C1)C)/C=C\1/SC(=S)N(C1=O)Cc1ccc(cc1)F
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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 C21H19FN4O3S2 MW 458.54 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H19FN4O3S2/c1-12-9-25(10-13(2)28-12)20-16(8-23)24-18(29-20)7-17-19(27)26(21(30)31-17)11-14-3-5-15(22)6-4-14/h3-7,12-13H,9-11H2,1-2H3/b17-7+InChIKey
GHQKOPJQEGSZAA-REZTVBANSA-NSynonyms
845637-97-0(E)5(26dimethylmorpholino)2((3(4fluorobenzyl)4oxo2thioxothiazolidin5ylidene)methyl)oxazole4carbonitrile
5(26dimethylmorpholin4yl)2((E)(3((4fluorophenyl)methyl)4oxo2sulfanylidene13thiazolidin5ylidene)methyl)13oxazole4carbonitrile
5(26dimethylmorpholin4yl)2((E)(3(4fluorobenzyl)4oxo2thioxo13thiazolidin5ylidene)methyl)13oxazole4carbonitrile
845637970
CC1CN(CC(O1)C)C2=C(N=C(O2)C=C3C(=O)N(C(=S)S3)CC4=CC=C(C=C4)F)C#N
InChI=1SC21H19FN4O3S2c112925(1013(2)2812)2016(823)2418(2920)71719(27)26(21(30)3117)11143515(22)6414h371213H911H212H3b177+
MFCD04167275
N#Cc1nc(oc1N1CC(C)OC(C1)C)C=C1SC(=S)N(C1=O)Cc1ccc(cc1)F
ZINC000013769013
ZINC000013769018
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