Vitas-M small molecule compound
(4E)-1-[5-(benzylsulfanyl)-1,3,4-thiadiazol-2-yl]-4-[(4-fluorophenyl)(hydroxy)methylidene]-5-(pyridin-3-yl)pyrrolidine-2,3-dione
Catalog ID
STK591317
SMILES Fc1ccc(cc1)/C(=C/1\C(=O)C(=O)N(C1c1cccnc1)c1nnc(s1)SCc1ccccc1)/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 C25H17FN4O3S2 MW 504.57 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H17FN4O3S2/c26-18-10-8-16(9-11-18)21(31)19-20(17-7-4-12-27-13-17)30(23(33)22(19)32)24-28-29-25(35-24)34-14-15-5-2-1-3-6-15/h1-13,20,31H,14H2/b21-19+InChIKey
MCKFVEGLOPDIMO-XUTLUUPISA-NSynonyms
848686-13-5(4E)1(5(benzylsulfanyl)134thiadiazol2yl)4((4fluorophenyl)(hydroxy)methylidene)5(pyridin3yl)pyrrolidine23dione
(4E)1(5BENZYLSULFANYL134THIADIAZOL2YL)4((4FLUOROPHENYL)HYDROXYMETHYLIDENE)5PYRIDIN3YLPYRROLIDINE23DIONE
848686135
C1=CC=C(C=C1)CSC2=NN=C(S2)N3C(C(=C(C4=CC=C(C=C4)F)O)C(=O)C3=O)C5=CN=CC=C5
Fc1ccc(cc1)C(=C1C(=O)C(=O)N(C1c1cccnc1)c1nnc(s1)SCc1ccccc1)O
InChI=1SC25H17FN4O3S2c261810816(91118)21(31)1920(177412271317)30(23(33)22(19)32)24282925(3524)3414155213615h1132031H14H2b2119+
MFCD07207853
ZINC000102608531
ZINC000102608535
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