Vitas-M small molecule compound
(1R,3S,5R,7S)-3-(5-bromo-3-nitro-1H-1,2,4-triazol-1-yl)-N-[4-(pyrrolidin-1-ylsulfonyl)phenyl]tricyclo[3.3.1.1~3,7~]decane-1-carboxamide
Catalog ID
STL172917
SMILES O=C([C@]12C[C@@H]3C[C@H](C1)C[C@](C2)(C3)n1nc(nc1Br)[N+](=O)[O-])Nc1ccc(cc1)S(=O)(=O)N1CCCC1
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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 C23H27BrN6O5S MW 579.47 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H27BrN6O5S/c24-20-26-21(30(32)33)27-29(20)23-12-15-9-16(13-23)11-22(10-15,14-23)19(31)25-17-3-5-18(6-4-17)36(34,35)28-7-1-2-8-28/h3-6,15-16H,1-2,7-14H2,(H,25,31)/t15-,16+,22+,23-InChIKey
LIOFNGYCADKXMP-UPQFZMOLSA-NSynonyms
489449-68-5(1R3S5R7S)3(5bromo3nitro1H124triazol1yl)N(4(pyrrolidin1ylsulfonyl)phenyl)tricyclo(3311~37~)decane1carboxamide
489449685
MFCD02174852
O=C((C@)12C(C@@H)3C(C@H)(C1)C(C@)(C2)(C3)n1nc(nc1Br)(N+)(=O)(O))Nc1ccc(cc1)S(=O)(=O)N1CCCC1
ZINC000103150484
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