Vitas-M small molecule compound
[5-(4-chlorophenyl)-1H-pyrazol-3-yl](1,4-dioxa-8-azaspiro[4.5]dec-8-yl)methanone
Catalog ID
STK879664
SMILES O=C(c1cc([nH]n1)c1ccc(cc1)Cl)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 C17H18ClN3O3 MW 347.80 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H18ClN3O3/c18-13-3-1-12(2-4-13)14-11-15(20-19-14)16(22)21-7-5-17(6-8-21)23-9-10-24-17/h1-4,11H,5-10H2,(H,19,20)InChIKey
FTTNVRCTWQMFNG-UHFFFAOYSA-NSynonyms
(3(4chlorophenyl)1Hpyrazol5yl)(14dioxa8azaspiro(45)decan8yl)methanone
(5(4chlorophenyl)1Hpyrazol3yl)(14dioxa8azaspiro(45)dec8yl)methanone
C1CN(CCC12OCCO2)C(=O)C3=CC(=NN3)C4=CC=C(C=C4)Cl
InChI=1SC17H18ClN3O3c18133112(2413)141115(201914)16(22)217517(6821)239102417h1411H510H2(H1920)
MFCD18170982
O=C(c1cc((nH)n1)c1ccc(cc1)Cl)N1CCC2(CC1)OCCO2
ZINC000024997678
ZINC24997678
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