Vitas-M small molecule compound
(5R,6R)-6-(4-nitro-1H-imidazol-1-yl)-5-phenyl-3-(thiophen-2-yl)cyclohex-2-en-1-one
Catalog ID
STK672488
SMILES O=C1C=C(C[C@@H]([C@H]1n1cnc(c1)[N+](=O)[O-])c1ccccc1)c1cccs1
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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 C19H15N3O3S MW 365.41 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H15N3O3S/c23-16-10-14(17-7-4-8-26-17)9-15(13-5-2-1-3-6-13)19(16)21-11-18(20-12-21)22(24)25/h1-8,10-12,15,19H,9H2/t15-,19-/m1/s1InChIKey
ZOODQONZQOFPIU-DNVCBOLYSA-NSynonyms
(5R6R)6(4nitro1Himidazol1yl)5phenyl3(thiophen2yl)cyclohex2en1one
(5R6R)6(4NITROIMIDAZOL1YL)5PHENYL3THIOPHEN2YLCYCLOHEX2EN1ONE
C1C(C(C(=O)C=C1C2=CC=CS2)N3C=C(N=C3)(N+)(=O)(O))C4=CC=CC=C4
InChI=1SC19H15N3O3Sc23161014(177482617)915(135213613)19(16)211118(201221)22(24)25h1810121519H9H2t1519m1s1
MFCD18246844
O=C1C=C(C(C@@H)((C@H)1n1cnc(c1)(N+)(=O)(O))c1ccccc1)c1cccs1
ZINC000001056191
ZINC01056191
ZINC1056191
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