Vitas-M small molecule compound
[5-(4-butoxyphenyl)-1H-pyrazol-4-yl](thiomorpholin-4-yl)methanone
Catalog ID
STL184181
SMILES CCCCOc1ccc(cc1)c1[nH]ncc1C(=O)N1CCSCC1
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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 C18H23N3O2S MW 345.47 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H23N3O2S/c1-2-3-10-23-15-6-4-14(5-7-15)17-16(13-19-20-17)18(22)21-8-11-24-12-9-21/h4-7,13H,2-3,8-12H2,1H3,(H,19,20)InChIKey
KLVXKEZJBTYGGL-UHFFFAOYSA-NSynonyms
(5(4butoxyphenyl)1Hpyrazol4yl)(thiomorpholin4yl)methanone
(5(4butoxyphenyl)1Hpyrazol4yl)thiomorpholin4ylmethanone
CCCCOC1=CC=C(C=C1)C2=C(C=NN2)C(=O)N3CCSCC3
CCCCOc1ccc(cc1)c1(nH)ncc1C(=O)N1CCSCC1
InChI=1SC18H23N3O2Sc1231023156414(5715)1716(13192017)18(22)218112412921h4713H23812H21H3(H1920)
MFCD22386323
ZINC000071011170
ZINC71011170
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