Vitas-M small molecule compound
tert-butyl [1-({3-[3-(1,3-benzodioxol-5-yl)-1,2,4-oxadiazol-5-yl]-6-oxo-5,6-dihydropyridazin-1(4H)-yl}acetyl)piperidin-4-yl]carbamate
Catalog ID
STL185311
SMILES O=C(OC(C)(C)C)NC1CCN(CC1)C(=O)CN1N=C(CCC1=O)c1onc(n1)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 C25H30N6O7 MW 526.55 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H30N6O7/c1-25(2,3)37-24(34)26-16-8-10-30(11-9-16)21(33)13-31-20(32)7-5-17(28-31)23-27-22(29-38-23)15-4-6-18-19(12-15)36-14-35-18/h4,6,12,16H,5,7-11,13-14H2,1-3H3,(H,26,34)InChIKey
NRGVVNMGWCEACE-UHFFFAOYSA-NSynonyms
CC(C)(C)OC(=O)NC1CCN(CC1)C(=O)CN2C(=O)CCC(=N2)C3=NC(=NO3)C4=CC5=C(C=C4)OCO5
InChI=1SC25H30N6O7c125(23)3724(34)261681030(11916)21(33)133120(32)7517(2831)232722(293823)15461819(1215)36143518h461216H57111314H213H3(H2634)
MFCD22387442
tertbutyl(1((3(3(13benzodioxol5yl)124oxadiazol5yl)6oxo56dihydropyridazin1(4H)yl)acetyl)piperidin4yl)carbamate
tertbutylN(1(2(3(3(13benzodioxol5yl)124oxadiazol5yl)6oxo45dihydropyridazin1yl)acetyl)piperidin4yl)carbamate
ZINC000072329723
ZINC72329723
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