Vitas-M small molecule compound
1-(1,3-benzodioxol-5-yl)-3-[1-(tricyclo[3.3.1.1~3,7~]dec-1-yl)butyl]thiourea
Catalog ID
STK456408
SMILES CCCC(C12CC3CC(C2)CC(C1)C3)NC(=S)Nc1ccc2c(c1)OCO2
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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 C22H30N2O2S MW 386.56 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H30N2O2S/c1-2-3-20(22-10-14-6-15(11-22)8-16(7-14)12-22)24-21(27)23-17-4-5-18-19(9-17)26-13-25-18/h4-5,9,14-16,20H,2-3,6-8,10-13H2,1H3,(H2,23,24,27)InChIKey
ZPMVJCWSOXXVKA-UHFFFAOYSA-NSynonyms
((ADAMANTANYLBUTYL)AMINO)(2HBENZO(34D)13DIOXOLAN5YLAMINO)METHANE1THIONE
1(1(1ADAMANTYL)BUTYL)3(13BENZODIOXOL5YL)THIOUREA
1(13benzodioxol5yl)3(1(tricyclo(3311~37~)dec1yl)butyl)thiourea
CCCC(C12CC3CC(C1)CC(C3)C2)NC(=S)NC4=CC5=C(C=C4)OCO5
InChI=1SC22H30N2O2Sc12320(221014615(1122)816(714)1222)2421(27)2317451819(917)26132518h459141620H23681013H21H3(H2232427)
ZINC000005041270
ZINC000005041271
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