Cas no 1872395-39-5 (Isavuconazonium iodide hydrochloride)

Isavuconazonium iodide hydrochloride structure
1872395-39-5 structure
Product Name:Isavuconazonium iodide hydrochloride
CAS No:1872395-39-5
MF:C35H36ClF2IN8O5S
MW:881.13
CID:5068253
Update Time:2021-12-13

Isavuconazonium iodide hydrochloride Chemical and Physical Properties

Names and Identifiers

    • Isavuconazonium iodide hydrochloride
    • 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
    • InChI Key: SGRYPJTWYZUIHZ-XFERGYADSA-M
    • 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-]
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