Vitas-M small molecule compound
5-fluoro-1,1'-dimethyl-3''-(prop-2-en-1-yl)-4'-(pyridin-3-yl)-2''-thioxo-4''H-dispiro[indole-3,2'-pyrrolidine-3',5''-[1,3]thiazolidine]-2,4''(1H)-dione
Catalog ID
STL058521
SMILES C=CCN1C(=S)SC2(C1=O)C(CN(C12c2cc(F)ccc2N(C1=O)C)C)c1cccnc1
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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 C23H21FN4O2S2 MW 468.58 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H21FN4O2S2/c1-4-10-28-20(30)23(32-21(28)31)17(14-6-5-9-25-12-14)13-26(2)22(23)16-11-15(24)7-8-18(16)27(3)19(22)29/h4-9,11-12,17H,1,10,13H2,2-3H3InChIKey
NIYRPKBLFMQILG-UHFFFAOYSA-NSynonyms
(3R3R)5fluoro11dimethyl4(prop2en1yl)4(pyridin3yl)5sulfanylidene12dihydrodispiro(indole32pyrrolidine32(14)thiazolidine)23dione
5fluoro11dimethyl3(prop2en1yl)4(pyridin3yl)2thioxo4Hdispiro(indole32pyrrolidine35(13)thiazolidine)24(1H)dione
C=CCN1C(=S)S(C@)2(C1=O)C(CN((C@)12c2cc(F)ccc2N(C1=O)C)C)c1cccnc1
CN1CC(C2(C13C4=C(C=CC(=C4)F)N(C3=O)C)C(=O)N(C(=S)S2)CC=C)C5=CN=CC=C5
InChI=1SC23H21FN4O2S2c14102820(30)23(3221(28)31)17(14659251214)1326(2)22(23)161115(24)7818(16)27(3)19(22)29h49111217H11013H223H3
MFCD08286989
ZINC000043732421
ZINC000227250921
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