QUILSECONAZOLE BESYLATE

Details

Stereochemistry	ABSOLUTE
Molecular Formula	C22H14F7N5O2.C6H6O3S
Molecular Weight	671.543
Optical Activity	UNSPECIFIED
Defined Stereocenters	1 / 1
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure Search

SMILES

OS(=O)(=O)C1=CC=CC=C1.O[C@@](CN2C=NN=N2)(C3=C(F)C=C(F)C=C3)C(F)(F)C4=CC=C(C=N4)C5=CC=C(OC(F)(F)F)C=C5

InChI

InChIKey=RWKAYIXGCZGIKU-BDQAORGHSA-N

InChI=1S/C22H14F7N5O2.C6H6O3S/c23-15-4-7-17(18(24)9-15)20(35,11-34-12-31-32-33-34)21(25,26)19-8-3-14(10-30-19)13-1-5-16(6-2-13)36-22(27,28)29;7-10(8,9)6-4-2-1-3-5-6/h1-10,12,35H,11H2;1-5H,(H,7,8,9)/t20-;/m0./s1

HIDE SMILES / InChI

Molecular Formula	C6H6O3S
Molecular Weight	158.175
Charge	0
Count

Stereochemistry	ACHIRAL
Additional Stereochemistry	No
Defined Stereocenters	0 / 0
E/Z Centers	0
Optical Activity	NONE

Molecular Formula	C22H14F7N5O2
Molecular Weight	513.3677
Charge	0
Count

Stereochemistry	ABSOLUTE
Additional Stereochemistry	No
Defined Stereocenters	1 / 1
E/Z Centers	0
Optical Activity	UNSPECIFIED

Approval Year

Substance Class	Chemical Created by `admin` on `Mon Mar 31 23:43:26 GMT 2025` Edited by `admin` on `Mon Mar 31 23:43:26 GMT 2025`
Record UNII	0286108BMM
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

QUILSECONAZOLE BESYLATE

Common Name

English

2-PYRIDINEETHANOL, .ALPHA.-(2,4-DIFLUOROPHENYL)-.BETA.,.BETA.-DIFLUORO-.ALPHA.-(1H-TETRAZOL-1-YLMETHYL)-5-(4-(TRIFLUOROMETHOXY)PHENYL)-, (.ALPHA.R)-, BENZENESULFONATE (1:1)

Preferred Name

English

VT-1129 BESYLATE

Common Name

English

Code System Code Type Description

SMS_ID

100000183400

Created by admin on Mon Mar 31 23:43:26 GMT 2025 , Edited by admin on Mon Mar 31 23:43:26 GMT 2025

PRIMARY

CAS

1809323-18-9

Created by admin on Mon Mar 31 23:43:26 GMT 2025 , Edited by admin on Mon Mar 31 23:43:26 GMT 2025

PRIMARY

FDA UNII

0286108BMM

Created by admin on Mon Mar 31 23:43:26 GMT 2025 , Edited by admin on Mon Mar 31 23:43:26 GMT 2025

PRIMARY

PUBCHEM

91886001

Created by admin on Mon Mar 31 23:43:26 GMT 2025 , Edited by admin on Mon Mar 31 23:43:26 GMT 2025

PRIMARY

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