Vitas-M small molecule compound
{1-[4-(3-tert-butyl-1,2,4-oxadiazol-5-yl)pyridin-2-yl]-1H-imidazol-4-yl}[4-(2,3-dimethylphenyl)piperazin-1-yl]methanone
Catalog ID
STL166337
SMILES O=C(c1ncn(c1)c1nccc(c1)c1onc(n1)C(C)(C)C)N1CCN(CC1)c1cccc(c1C)C
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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 C27H31N7O2 MW 485.59 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H31N7O2/c1-18-7-6-8-22(19(18)2)32-11-13-33(14-12-32)25(35)21-16-34(17-29-21)23-15-20(9-10-28-23)24-30-26(31-36-24)27(3,4)5/h6-10,15-17H,11-14H2,1-5H3InChIKey
PWQRHXHELFUNIZ-UHFFFAOYSA-NSynonyms
(1(4(3tertbutyl124oxadiazol5yl)pyridin2yl)1Himidazol4yl)(4(23dimethylphenyl)piperazin1yl)methanone
(1(4(3tertbutyl124oxadiazol5yl)pyridin2yl)imidazol4yl)(4(23dimethylphenyl)piperazin1yl)methanone
CC1=C(C(=CC=C1)N2CCN(CC2)C(=O)C3=CN(C=N3)C4=NC=CC(=C4)C5=NC(=NO5)C(C)(C)C)C
InChI=1SC27H31N7O2c11876822(19(18)2)32111333(141232)25(35)211634(172921)231520(9102823)243026(313624)27(34)5h6101517H1114H215H3
MFCD20748519
ZINC000071768235
ZINC71768235
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