PF-03654746 TOSYLATE

Details

Stereochemistry	ACHIRAL
Molecular Formula	C18H24F2N2O.C7H8O3S
Molecular Weight	494.594
Optical Activity	UNSPECIFIED
Defined Stereocenters	2 / 2
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure Search

SMILES

CC1=CC=C(C=C1)S(O)(=O)=O.CCNC(=O)[C@H]2C[C@](F)(C2)C3=CC(F)=C(CN4CCCC4)C=C3

InChI

InChIKey=IKAYTZLLIWAEDV-WXWMPIANSA-N

InChI=1S/C18H24F2N2O.C7H8O3S/c1-2-21-17(23)14-10-18(20,11-14)15-6-5-13(16(19)9-15)12-22-7-3-4-8-22;1-6-2-4-7(5-3-6)11(8,9)10/h5-6,9,14H,2-4,7-8,10-12H2,1H3,(H,21,23);2-5H,1H3,(H,8,9,10)/t14-,18-;

HIDE SMILES / InChI

Molecular Formula	C18H24F2N2O
Molecular Weight	322.3928
Charge	0
Count

Stereochemistry	ABSOLUTE
Additional Stereochemistry	No
Defined Stereocenters	2 / 2
E/Z Centers	0
Optical Activity	UNSPECIFIED

Molecular Formula	C7H8O3S
Molecular Weight	172.202
Charge	0
Count

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

Approval Year

Substance Class	Chemical Created by `admin` on `Fri Dec 15 15:59:54 UTC 2023` Edited by `admin` on `Fri Dec 15 15:59:54 UTC 2023`
Record UNII	V600I6H7T6
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

PF-03654746 TOSYLATE

Common Name

English

CYCLOBUTANECARBOXAMIDE, N-ETHYL-3-FLUORO-3-(3-FLUORO-4-(1-PYRROLIDINYLMETHYL)PHENYL)-, TRANS-, 4-METHYLBENZENESULFONATE (1:1)

Common Name

English

Code System Code Type Description

PUBCHEM

24862242

Created by admin on Fri Dec 15 15:59:54 UTC 2023 , Edited by admin on Fri Dec 15 15:59:54 UTC 2023

PRIMARY

FDA UNII

V600I6H7T6

Created by admin on Fri Dec 15 15:59:54 UTC 2023 , Edited by admin on Fri Dec 15 15:59:54 UTC 2023

PRIMARY

CAS

1039399-17-1

Created by admin on Fri Dec 15 15:59:54 UTC 2023 , Edited by admin on Fri Dec 15 15:59:54 UTC 2023

PRIMARY

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