epi-Isavuconazonium Iodide Hydrochloride

分析物名称

epi-Isavuconazonium Iodide Hydrochloride

CAS登记号

2169911-48-0

分子式

C35H35F2N8O5S . HCl . I

分子量

881.13

精确质量测定

880.12

SMILES

CNCC(OCC1=CC=CN=C1N(C)C(OC(C)[N+]2=CN(C[C@](C3=CC(F)=CC=C3F)([C@H](C)C4=NC(C5=CC=C(C#N)C=C5)=CS4)O)N=C2)=O)=O.Cl.[I-]

InChI

InChI=1S/C35H35F2N8O5S.ClH.HI/c1-22(33-42-30(18-51-33)25-9-7-24(15-38)8-10-25)35(48,28-14-27(36)11-12-29(28)37)19-45-21-44(20-41-45)23(2)50-34(47)43(4)32-26(6-5-13-40-32)17-49-31(46)16-39-3;;/h5-14,18,20-23,39,48H,16-17,19H2,1-4H3;2*1H/q+1;;/p-1/t22-,23?,35-;;/m1../s1

IUPAC

1-((2R,3S)-3-(4-(4-cyanophenyl)thiazol-2-yl)-2-(2,5-difluorophenyl)-2-hydroxybutyl)-4-(1-((methyl(3-(((methylglycyl)oxy)methyl)pyridin-2-yl)carbamoyl)oxy)ethyl)-1H-1,2,4-triazol-4-ium iodide hydrochloride

运输温度

Room Temperature

原产国

CANADA

产品形式

Neat