Vitas-M small molecule compound
4-[(E)-(5-oxo-2-thioxoimidazolidin-4-ylidene)methyl]phenyl 4-fluorobenzoate
Catalog ID
STL428204
SMILES O=C(c1ccc(cc1)F)Oc1ccc(cc1)/C=C\1/NC(=S)NC1=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 C17H11FN2O3S MW 342.35 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H11FN2O3S/c18-12-5-3-11(4-6-12)16(22)23-13-7-1-10(2-8-13)9-14-15(21)20-17(24)19-14/h1-9H,(H2,19,20,21,24)/b14-9+InChIKey
MPNOFDFKLOZHMX-NTEUORMPSA-NSynonyms
(4((E)(5oxo2sulfanylideneimidazolidin4ylidene)methyl)phenyl)4fluorobenzoate
4((E)(5oxo2thioxoimidazolidin4ylidene)methyl)phenyl4fluorobenzoate
C1=CC(=CC=C1C=C2C(=O)NC(=S)N2)OC(=O)C3=CC=C(C=C3)F
InChI=1SC17H11FN2O3Sc18125311(4612)16(22)23137110(2813)91415(21)2017(24)1914h19H(H219202124)b149+
MFCD00650436
O=C(c1ccc(cc1)F)Oc1ccc(cc1)C=C1NC(=S)NC1=O
ZINC000000975872
ZINC00975872
ZINC975872
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