Vitas-M small molecule compound
[5-fluoro-2-(1H-tetrazol-1-yl)phenyl](4a-hydroxyoctahydroisoquinolin-2(1H)-yl)methanone
Catalog ID
STL319888
SMILES Fc1ccc(c(c1)C(=O)N1CCC2(C(C1)CCCC2)O)n1cnnn1
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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 C17H20FN5O2 MW 345.38 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H20FN5O2/c18-13-4-5-15(23-11-19-20-21-23)14(9-13)16(24)22-8-7-17(25)6-2-1-3-12(17)10-22/h4-5,9,11-12,25H,1-3,6-8,10H2InChIKey
RJWQAWNDZDVINI-UHFFFAOYSA-NSynonyms
(4ahydroxy13456788aoctahydroisoquinolin2yl)(5fluoro2(tetrazol1yl)phenyl)methanone
(5fluoro2(1Htetrazol1yl)phenyl)((4aS8aS)4ahydroxyoctahydroisoquinolin2(1H)yl)methanone
(5fluoro2(1Htetrazol1yl)phenyl)(4ahydroxyoctahydroisoquinolin2(1H)yl)methanone
C1CCC2(CCN(CC2C1)C(=O)C3=C(C=CC(=C3)F)N4C=NN=N4)O
Fc1ccc(c(c1)C(=O)N1CC(C@@)2((C@H)(C1)CCCC2)O)n1cnnn1
InChI=1SC17H20FN5O2c18134515(231119202123)14(913)16(24)228717(25)621312(17)1022h459111225H136810H2
MFCD28029182
ZINC000095480408
ZINC000095480411
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