Vazegepant vrije basis

Chemische naam:

(R)-N-(3-(7-methyl-1H-indazool-5-yl)-1-(4-(1-methylpiperidine-4-yl)piperazine-1-yl)-1-oxopropaan-2- yl)-4-(2-oxo-1,2-dihydrochinolin-3-yl)piperidine-1-carboxamide

SMILES-code:

O=C(N1CCC(C2=CC3=C(NC2=O)C=CC=C3)CC1)N[C@H](CC4=CC5=C(NN=C5)C(C)=C4)C( N6CCN(C7CCN(C)CC7)CC6)=O

InChi-code:

InChI=1S/C36H46N8O3/c1-24-19-25(20-28-23-37-40-33(24)28)21-32(3 5(46)43-17-15-42(16-18-43)29-9-11-41(2)12-10-29)39-36(47)44-13-7 -26(8-14-44)30-22-27-5-3-4-6-31(27)38-34(30)45/u3-6,19-20,22-23, 26,29,32H,7-18,21H2,1-2H3,(H,37,40)(H,38,45)(H,39,47)/t32-/m1/s1

InChi-sleutel:

JJVAPHYEOZSKJZ-JGCGQSQUSA-N

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