Vitas-M small molecule compound
2-(4-{[4-(1,2-benzothiazol-3-yl)piperazin-1-yl]carbonothioyl}-2-methoxyphenoxy)acetamide
Catalog ID
STK623533
SMILES COc1cc(ccc1OCC(=O)N)C(=S)N1CCN(CC1)c1nsc2c1cccc2
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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 C21H22N4O3S2 MW 442.56 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H22N4O3S2/c1-27-17-12-14(6-7-16(17)28-13-19(22)26)21(29)25-10-8-24(9-11-25)20-15-4-2-3-5-18(15)30-23-20/h2-7,12H,8-11,13H2,1H3,(H2,22,26)InChIKey
JKBQIPOURCXQBC-UHFFFAOYSA-NSynonyms
951945-40-72(4((4(12benzothiazol3yl)piperazin1yl)carbonothioyl)2methoxyphenoxy)acetamide
2(4(4(12benzothiazol3yl)piperazine1carbothioyl)2methoxyphenoxy)acetamide
2(4(4(benzo(d)isothiazol3yl)piperazine1carbonothioyl)2methoxyphenoxy)acetamide
951945407
COC1=C(C=CC(=C1)C(=S)N2CCN(CC2)C3=NSC4=CC=CC=C43)OCC(=O)N
InChI=1SC21H22N4O3S2c127171214(6716(17)281319(22)26)21(29)2510824(91125)2015423518(15)302320h2712H81113H21H3(H22226)
MFCD09855522
ZINC000013722754
ZINC13722754
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