Vitas-M small molecule compound
11-{(5E)-4-oxo-5-[2-oxo-1-(2-oxo-2-{[3-(trifluoromethyl)phenyl]amino}ethyl)-1,2-dihydro-3H-indol-3-ylidene]-2-thioxo-1,3-thiazolidin-3-yl}undecanoic acid
Catalog ID
STK706422
SMILES O=C(CN1C(=O)/C(=C\2/SC(=S)N(C2=O)CCCCCCCCCCC(=O)O)/c2c1cccc2)Nc1cccc(c1)C(F)(F)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 C31H32F3N3O5S2 MW 647.74 g/mol Purity >90% as per NMR
InChI
InChI=1S/C31H32F3N3O5S2/c32-31(33,34)20-12-11-13-21(18-20)35-24(38)19-37-23-15-9-8-14-22(23)26(28(37)41)27-29(42)36(30(43)44-27)17-10-6-4-2-1-3-5-7-16-25(39)40/h8-9,11-15,18H,1-7,10,16-17,19H2,(H,35,38)(H,39,40)/b27-26+InChIKey
KUTDMRBHSROZAM-CYYJNZCTSA-NSynonyms
(Z)11(4oxo5(2oxo1(2oxo2((3(trifluoromethyl)phenyl)amino)ethyl)indolin3ylidene)2thioxothiazolidin3yl)undecanoicacid
11((5E)4oxo5(2oxo1(2oxo2((3(trifluoromethyl)phenyl)amino)ethyl)12dihydro3Hindol3ylidene)2thioxo13thiazolidin3yl)undecanoicacid
11((5E)4oxo5(2oxo1(2oxo2(3(trifluoromethyl)anilino)ethyl)indol3ylidene)2sulfanylidene13thiazolidin3yl)undecanoicacid
C1=CC=C2C(=C1)C(=C3C(=O)N(C(=S)S3)CCCCCCCCCCC(=O)O)C(=O)N2CC(=O)NC4=CC=CC(=C4)C(F)(F)F
InChI=1SC31H32F3N3O5S2c3231(3334)2012111321(1820)3524(38)19372315981422(23)26(28(37)41)2729(42)36(30(43)4427)171064213571625(39)40h89111518H1710161719H2(H3538)(H3940)b2726+
MFCD03212130
O=C(CN1C(=O)C(=C2SC(=S)N(C2=O)CCCCCCCCCCC(=O)O)c2c1cccc2)Nc1cccc(c1)C(F)(F)F
ZINC000097947085
ZINC97947085
Check stock
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