Vitas-M small molecule compound
1,4-dioxa-8-azaspiro[4.5]dec-8-yl[5-(4-methoxyphenyl)-1H-pyrazol-3-yl]methanone
Catalog ID
STK985058
SMILES COc1ccc(cc1)c1[nH]nc(c1)C(=O)N1CCC2(CC1)OCCO2
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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 C18H21N3O4 MW 343.38 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H21N3O4/c1-23-14-4-2-13(3-5-14)15-12-16(20-19-15)17(22)21-8-6-18(7-9-21)24-10-11-25-18/h2-5,12H,6-11H2,1H3,(H,19,20)InChIKey
TVOCTIWJPZQFAD-UHFFFAOYSA-NSynonyms
14dioxa8azaspiro(45)dec8yl(5(4methoxyphenyl)1Hpyrazol3yl)methanone
14DIOXA8AZASPIRO(45)DECAN8YL(3(4METHOXYPHENYL)1HPYRAZOL5YL)METHANONE
COC1=CC=C(C=C1)C2=NNC(=C2)C(=O)N3CCC4(CC3)OCCO4
COc1ccc(cc1)c1(nH)nc(c1)C(=O)N1CCC2(CC1)OCCO2
InChI=1SC18H21N3O4c123144213(3514)151216(201915)17(22)218618(7921)2410112518h2512H611H21H3(H1920)
MFCD18182091
ZINC000006736829
ZINC06736829
ZINC6736829
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