Vitas-M small molecule compound
5-ethyl-2-(4-methoxyphenyl)-7-methyl-1,3-diazatricyclo[3.3.1.1~3,7~]decan-6-one
Catalog ID
STL448491
SMILES COc1ccc(cc1)C1N2CC3(CN1CC(C2)(C3=O)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 C18H24N2O2 MW 300.40 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H24N2O2/c1-4-18-11-19-9-17(2,16(18)21)10-20(12-18)15(19)13-5-7-14(22-3)8-6-13/h5-8,15H,4,9-12H2,1-3H3InChIKey
JIHIKJGVHRJZQS-UHFFFAOYSA-NSynonyms
(1S5S7R)5ethyl2(4methoxyphenyl)7methyl13diazaadamantan6one
5ethyl2(4methoxyphenyl)7methyl13diazatricyclo(3311~37~)decan6one
CCC12CN3CC(C1=O)(CN(C2)C3C4=CC=C(C=C4)OC)C
COc1ccc(cc1)C1N2C(C@@)3(CN1C(C@)(C2)(C3=O)CC)C
InChI=1SC18H24N2O2c14181119917(216(18)21)1020(1218)15(19)135714(223)8613h5815H4912H213H3
MFCD08060326
ZINC000019323572
ZINC19323572
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