(2S,3S)-2-(2,4-difluorophenyl)-3-(5-fluoro-4-pyrimidinyl)-1-(1,2,4-triazol-1-yl)-2-butanol (Q27166445)

VORICONAZOLE IMPURITY D (English)

(2R,3R)-2-(2,4-Difluorophenyl)-3-(5-fluoropyrimidin-4-yl)-1-(1H-1,2,4-triazol-1-yl)butan-2-ol

9 October 2016

stereoisomer of

1 reference

1 reference

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C₁₆H₁₄F₃N₅O

1 reference

VORICONAZOLE IMPURITY D (English)

9 October 2016

canonical SMILES

CC(C1=NC=NC=C1F)C(CN2C=NC=N2)(C3=C(C=C(C=C3)F)F)O

1 reference

VORICONAZOLE IMPURITY D (English)

9 October 2016

isomeric SMILES

C[C@@H](C1=NC=NC=C1F)[C@@](CN2C=NC=N2)(C3=C(C=C(C=C3)F)F)O

1 reference

VORICONAZOLE IMPURITY D (English)

InChI=1S/C16H14F3N5O/c1-10(15-14(19)5-20-7-22-15)16(25,6-24-9-21-8-23-24)12-3-2-11(17)4-13(12)18/h2-5,7-10,25H,6H2,1H3/t10-,16-/m0/s1

9 October 2016

Identifiers

InChI

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VORICONAZOLE IMPURITY D (English)

BCEHBSKCWLPMDN-QFYYESIMSA-N

9 October 2016

InChIKey

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VORICONAZOLE IMPURITY D (English)

9 October 2016

stated in

ChEBI release 2020-09-01

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VORICONAZOLE IMPURITY D (English)

9 October 2016

ChEBI ID

94626

mapping relation type

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