Vitas-M small molecule compound
5-butyl-2-(4-ethylphenyl)-7-methyl-1,3-diazatricyclo[3.3.1.1~3,7~]decan-6-one
Catalog ID
STL522269
SMILES CCCCC12CN3CC(C2=O)(CN(C1)C3c1ccc(cc1)CC)C
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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 C21H30N2O MW 326.48 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H30N2O/c1-4-6-11-21-14-22-12-20(3,19(21)24)13-23(15-21)18(22)17-9-7-16(5-2)8-10-17/h7-10,18H,4-6,11-15H2,1-3H3InChIKey
RRXBWDQPCQYJQG-UHFFFAOYSA-NSynonyms
956962-35-9(5s7s)5butyl2(4ethylphenyl)7methyl13diazaadamantan6one
1754724
5butyl2(4ethylphenyl)7methyl13diazatricyclo(3311^(37))decan6one
5butyl2(4ethylphenyl)7methyl13diazatricyclo(3311~37~)decan6one
956962359
CCCC(C@)12CN3C(C@@)(C2=O)(CN(C1)C3c1ccc(cc1)CC)C
InChI=1SC21H30N2Oc146112114221220(319(21)24)1323(1521)18(22)179716(52)81017h71018H461115H213H3
MFCD06166310
ZINC000019320078
ZINC19320078
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