Vitas-M small molecule compound
(5E)-1-(4-fluorobenzyl)-5-{[(4-fluorobenzyl)amino]methylidene}-2-sulfanylpyrimidine-4,6(1H,5H)-dione
Catalog ID
STL055401
SMILES Fc1ccc(cc1)CN/C=C/1\C(=O)N=C(N(C1=O)Cc1ccc(cc1)F)S
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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 C19H15F2N3O2S MW 387.41 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H15F2N3O2S/c20-14-5-1-12(2-6-14)9-22-10-16-17(25)23-19(27)24(18(16)26)11-13-3-7-15(21)8-4-13/h1-8,10,22H,9,11H2,(H,23,25,27)/b16-10+InChIKey
BNDLHHJROKDOPC-MHWRWJLKSA-NSynonyms
(5E)1((4FLUOROPHENYL)METHYL)5(((4FLUOROPHENYL)METHYLAMINO)METHYLIDENE)2SULFANYLIDENE13DIAZINANE46DIONE
(5E)1(4fluorobenzyl)5(((4fluorobenzyl)amino)methylidene)2sulfanylpyrimidine46(1H5H)dione
C1=CC(=CC=C1CNC=C2C(=O)NC(=S)N(C2=O)CC3=CC=C(C=C3)F)F
Fc1ccc(cc1)CNC=C1C(=O)N=C(N(C1=O)Cc1ccc(cc1)F)S
InChI=1SC19H15F2N3O2Sc20145112(2614)922101617(25)2319(27)24(18(16)26)11133715(21)8413h181022H911H2(H232527)b1610+
MFCD05735550
ZINC000001897858
ZINC000103126391
ZINC01897858
ZINC1897858
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