Vitas-M small molecule compound
methyl 4-{2,5-dioxo-3-[4-(tricyclo[3.3.1.1~3,7~]dec-1-yl)piperazin-1-yl]pyrrolidin-1-yl}benzoate
Catalog ID
STK678270
SMILES COC(=O)c1ccc(cc1)N1C(=O)CC(C1=O)N1CCN(CC1)C12CC3CC(C2)CC(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 C26H33N3O4 MW 451.57 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H33N3O4/c1-33-25(32)20-2-4-21(5-3-20)29-23(30)13-22(24(29)31)27-6-8-28(9-7-27)26-14-17-10-18(15-26)12-19(11-17)16-26/h2-5,17-19,22H,6-16H2,1H3InChIKey
VCGQRVLMKIIIOV-UHFFFAOYSA-NSynonyms
COC(=O)C1=CC=C(C=C1)N2C(=O)CC(C2=O)N3CCN(CC3)C45CC6CC(C4)CC(C6)C5
InChI=1SC26H33N3O4c13325(32)202421(5320)2923(30)1322(24(29)31)276828(9727)2614171018(1526)1219(1117)1626h25171922H616H21H3
methyl4(25dioxo3(4(tricyclo(3311~37~)dec1yl)piperazin1yl)pyrrolidin1yl)benzoate
METHYL4(3(4(1ADAMANTYL)PIPERAZIN1YL)25DIOXOPYRROLIDIN1YL)BENZOATE
METHYL4(3(4ADAMANTANYLPIPERAZINYL)25DIOXOAZOLIDINYL)BENZOATE
MFCD03034368
ZINC000022753156
ZINC000100112606
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