Vitas-M small molecule compound
1-[3-(1,3-benzodioxol-5-yl)-1H-pyrazol-5-yl]-1,4-diazepane
Catalog ID
STL124608
SMILES N1CCCN(CC1)c1[nH]nc(c1)c1ccc2c(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 C15H18N4O2 MW 286.33 g/mol Purity >90% as per NMR
InChI
InChI=1S/C15H18N4O2/c1-4-16-5-7-19(6-1)15-9-12(17-18-15)11-2-3-13-14(8-11)21-10-20-13/h2-3,8-9,16H,1,4-7,10H2,(H,17,18)InChIKey
LTDXYTMRJAQZIM-UHFFFAOYSA-NSynonyms
1(3(13benzodioxol5yl)1Hpyrazol5yl)14diazepane
1(5(13benzodioxol5yl)1Hpyrazol3yl)14diazepane
C1CNCCN(C1)C2=NNC(=C2)C3=CC4=C(C=C3)OCO4
InChI=1SC15H18N4O2c14165719(61)15912(171815)11231314(811)21102013h238916H14710H2(H1718)
MFCD20734612
N1CCCN(CC1)c1(nH)nc(c1)c1ccc2c(c1)OCO2
ZINC000067225300
ZINC67225300
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