1872395-39-5 (Isavuconazonium iodide hydrochloride,Isavuconazonium iodide hydrochloride)

CAS号:
1872395-39-5
中文名称:
Isavuconazonium iodide hydrochloride
英文名称:
Isavuconazonium iodide hydrochloride
分子式:
C35H36ClF2IN8O5S
分子量:
881.13

Isavuconazonium iodide hydrochloride(1872395-39-5)名称与标识符

标识符

InChIKey:
SGRYPJTWYZUIHZ-XFERGYADSA-M
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+;;/m0../s1
SMILES:
C1C(COC(=O)CNC)=C(N=CC=1)N(C)C(=O)OC(C)[N+]1C=NN(C[C@@]([C@@H](C)C2=NC(=CS2)C2C=CC(=CC=2)C#N)(C2=C(F)C=CC(=C2)F)O)C=1.Cl.[I-]