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Itraconazole EP Impurity B

SZ CAT No SZ-I011003
CAS No 854372-77-3
Mol.F. C35H38Cl2N8O4
Mol.Wt. 705.6
Inv. Status Under Synthesis


Chemical Name: Rel-4-[4-[4-[4-[[(2R,4S)-2-(2,4-Dichlorophenyl)-2-(4H-1,2,4-triazol-4-ylmethyl)-1,3-dioxolan-4-yl]methoxy]phenyl]-1-piperazinyl]phenyl]-2,4-dihydro-2-(1-methylpropyl)-3H-1,2,4-triazol-3-one

Synonym: Itraconazole N4-Isomer

Smiles: O=C1N(C(C)CC)N=CN1C2=CC=C(N3CCN(C4=CC=C(OC[C@H]5O[C@](CN6C=NN=C6)(C7=CC=C(Cl)C=C7Cl)OC5)C=C4)CC3)C=C2

Inchi: InChI=1S/C34H34Cl2N8O4/c1-2-13-44-33(45)43(24-39-44)28-6-4-26(5-7-28)40-14-16-41(17-15-40)27-8-10-29(11-9-27)46-19-30-20-47-34(48-30,21-42-23-37-22-38-42)31-12-3-25(35)18-32(31)36/h2-12,18,22-24,30H,1,13-17,19-21H2/t30-,34-/m0/s1