Vitas-M small molecule compound
(4a-hydroxyoctahydroisoquinolin-2(1H)-yl)[3-(1H-tetrazol-1-yl)phenyl]methanone
Catalog ID
STL155813
SMILES O=C(c1cccc(c1)n1cnnn1)N1CCC2(C(C1)CCCC2)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 C17H21N5O2 MW 327.39 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H21N5O2/c23-16(13-4-3-6-15(10-13)22-12-18-19-20-22)21-9-8-17(24)7-2-1-5-14(17)11-21/h3-4,6,10,12,14,24H,1-2,5,7-9,11H2InChIKey
KRVHHBFEEKZFCG-UHFFFAOYSA-NSynonyms
(3(1Htetrazol1yl)phenyl)((4aS8aS)4ahydroxyoctahydroisoquinolin2(1H)yl)methanone
(4ahydroxy13456788aoctahydroisoquinolin2yl)(3(tetrazol1yl)phenyl)methanone
(4ahydroxyoctahydroisoquinolin2(1H)yl)(3(1Htetrazol1yl)phenyl)methanone
C1CCC2(CCN(CC2C1)C(=O)C3=CC(=CC=C3)N4C=NN=N4)O
InChI=1SC17H21N5O2c2316(1343615(1013)221218192022)219817(24)721514(17)1121h34610121424H1257911H2
MFCD20757447
O=C(c1cccc(c1)n1cnnn1)N1CC(C@@)2((C@H)(C1)CCCC2)O
ZINC000061722182
ZINC000071328976
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