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Ravuconazole-[d4]

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General Information
Catalog: BLP-004106
CAS: 1329499-27-5
Molecular Formula: C22H13D4F2N5OS
Molecular Weight: 441.49

Chemical Structure

Description	Ravuconazole-[d4] is an isotope analogue of Ravuconazole. Ravuconazole, also known as BMS-207147 or ER-30346, is a potent, broad spectrum triazoleantifungle agent and an ergosterol biosynthesis inhibitor.
Synonyms	4-[2-[(1R,2R)-2-(2,4-Difluorophenyl)-2-hydroxy-1-methyl-3-(1H-1,2,4-triazol-1-yl)propyl]-4-thiazolyl]benzonitrile-d4; [R-(R,R)]-4-[2-[2-(2,4-Difluorophenyl)-2-hydroxy-1-methyl-3-(1H 1,2,4-triazol-1-yl)propyl]-4 thiazolyl]benzonitrile-d4; BMS 207147-d4; ER 30346-d4
IUPAC Name	2,3,5,6-tetradeuterio-4-[2-[(2R,3R)-3-(2,4-difluorophenyl)-3-hydroxy-4-(1,2,4-triazol-1-yl)butan-2-yl]-1,3-thiazol-4-yl]benzonitrile
Related CAS	182760-06-1 (unlabelled)
Canonical SMILES	CC(C1=NC(=CS1)C2=CC=C(C=C2)C#N)C(CN3C=NC=N3)(C4=C(C=C(C=C4)F)F)O
InChI	InChI=1S/C22H17F2N5OS/c1-14(21-28-20(10-31-21)16-4-2-15(9-25)3-5-16)22(30,11-29-13-26-12-27-29)18-7-6-17(23)8-19(18)24/h2-8,10,12-14,30H,11H2,1H3/t14-,22+/m0/s1/i2D,3D,4D,5D
InChI Key	OPAHEYNNJWPQPX-KUXFOAEVSA-N
Melting Point	158-161°C
Purity	≥90%
Solubility	Soluble in Chloroform (Slightly), DMSO (Slightly), Methanol (Slightly)
Appearance	White to Off-white Solid
Storage	Store at-20°C