Vitas-M small molecule compound
5-(2,4-dimethoxyphenyl)-N-[1-hydroxy-4-(methylsulfanyl)butan-2-yl]-1H-pyrazole-3-carboxamide
Catalog ID
STL421879
SMILES CSCCC(NC(=O)c1n[nH]c(c1)c1ccc(cc1OC)OC)CO
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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 C17H23N3O4S MW 365.45 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H23N3O4S/c1-23-12-4-5-13(16(8-12)24-2)14-9-15(20-19-14)17(22)18-11(10-21)6-7-25-3/h4-5,8-9,11,21H,6-7,10H2,1-3H3,(H,18,22)(H,19,20)InChIKey
PSPXIBVFMRCDDJ-UHFFFAOYSA-NSynonyms
(S)3(24dimethoxyphenyl)N(1hydroxy4(methylthio)butan2yl)1Hpyrazole5carboxamide
3(24dimethoxyphenyl)N(1hydroxy4methylsulfanylbutan2yl)1Hpyrazole5carboxamide
5(24dimethoxyphenyl)N(1hydroxy4(methylsulfanyl)butan2yl)1Hpyrazole3carboxamide
COC1=CC(=C(C=C1)C2=NNC(=C2)C(=O)NC(CCSC)CO)OC
CSCC(C@H)(NC(=O)c1(nH)nc(c1)c1ccc(cc1OC)OC)CO
CSCCC(NC(=O)c1n(nH)c(c1)c1ccc(cc1OC)OC)CO
InChI=1SC17H23N3O4Sc123124513(16(812)242)14915(201914)17(22)1811(1021)67253h45891121H6710H213H3(H1822)(H1920)
MFCD30707806
ZINC000218337317
ZINC000253394704
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