Vitas-M small molecule compound
(5Z)-5-{[2,5-dimethyl-1-(4-nitrophenyl)-1H-pyrrol-3-yl]methylidene}-3-ethyl-2-thioxoimidazolidin-4-one
Catalog ID
STL371599
SMILES CCN1C(=S)N/C(=C\c2cc(n(c2C)c2ccc(cc2)[N+](=O)[O-])C)/C1=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 C18H18N4O3S MW 370.43 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H18N4O3S/c1-4-20-17(23)16(19-18(20)26)10-13-9-11(2)21(12(13)3)14-5-7-15(8-6-14)22(24)25/h5-10H,4H2,1-3H3,(H,19,26)/b16-10-InChIKey
FBWRHLQHUUWPDL-YBEGLDIGSA-NSynonyms
(5Z)5((25dimethyl1(4nitrophenyl)1Hpyrrol3yl)methylidene)3ethyl2thioxoimidazolidin4one
(5Z)5((25DIMETHYL1(4NITROPHENYL)PYRROL3YL)METHYLIDENE)3ETHYL2SULFANYLIDENEIMIDAZOLIDIN4ONE
CCN1C(=O)C(=CC2=C(N(C(=C2)C)C3=CC=C(C=C3)(N+)(=O)(O))C)NC1=S
CCN1C(=S)NC(=Cc2cc(n(c2C)c2ccc(cc2)(N+)(=O)(O))C)C1=O
InChI=1SC18H18N4O3Sc142017(23)16(1918(20)26)1013911(2)21(12(13)3)145715(8614)22(24)25h510H4H213H3(H1926)b1610
MFCD03711827
ZINC000004845797
ZINC04845797
ZINC4845797
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