Vitas-M small molecule compound
(4-ethylphenyl)(1,3,5-triazatricyclo[3.3.1.1~3,7~]dec-7-yl)methanone
Catalog ID
STK700034
SMILES CCc1ccc(cc1)C(=O)C12CN3CN(C2)CN(C1)C3
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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 C16H21N3O MW 271.36 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H21N3O/c1-2-13-3-5-14(6-4-13)15(20)16-7-17-10-18(8-16)12-19(9-16)11-17/h3-6H,2,7-12H2,1H3InChIKey
BHWBHFOCUIYOJA-UHFFFAOYSA-NSynonyms
149034-82-2(1s3s5s)135triazaadamantan7yl(4ethylphenyl)methanone
(4ethylphenyl)(135triazatricyclo(3311~37~)dec7yl)methanone
149034822
CCC1=CC=C(C=C1)C(=O)C23CN4CN(C2)CN(C3)C4
InChI=1SC16H21N3Oc12133514(6413)15(20)167171018(816)1219(916)1117h36H2712H21H3
ZINC000095481282
ZINC95481282
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