Vitas-M small molecule compound
3-chloro-N-[(4-ethoxyphenyl)(4-hydroxybutyl)carbamothioyl]-1-benzothiophene-2-carboxamide
Catalog ID
STL064199
SMILES OCCCCN(C(=S)NC(=O)c1sc2c(c1Cl)cccc2)c1ccc(cc1)OCC
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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 C22H23ClN2O3S2 MW 463.02 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H23ClN2O3S2/c1-2-28-16-11-9-15(10-12-16)25(13-5-6-14-26)22(29)24-21(27)20-19(23)17-7-3-4-8-18(17)30-20/h3-4,7-12,26H,2,5-6,13-14H2,1H3,(H,24,27,29)InChIKey
WDWUYRAMOLXVTH-UHFFFAOYSA-NSynonyms
3chloroN((4ethoxyphenyl)(4hydroxybutyl)carbamothioyl)1benzothiophene2carboxamide
CCOC1=CC=C(C=C1)N(CCCCO)C(=S)NC(=O)C2=C(C3=CC=CC=C3S2)Cl
InChI=1SC22H23ClN2O3S2c12281611915(101216)25(13561426)22(29)2421(27)2019(23)17734818(17)3020h3471226H2561314H21H3(H242729)
MFCD05085130
ZINC000002886284
ZINC02886284
ZINC2886284
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