PF-03654764 TOSYLATE

Details

Stereochemistry	ACHIRAL
Molecular Formula	C20H28F2N2O.C7H8O3S
Molecular Weight	522.648
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.CC(C)CNC(=O)[C@H]2C[C@](F)(C2)C3=CC(F)=C(CN4CCCC4)C=C3

InChI

InChIKey=BPIHLWHJMOUNOO-VCMDNOCUSA-N

InChI=1S/C20H28F2N2O.C7H8O3S/c1-14(2)12-23-19(25)16-10-20(22,11-16)17-6-5-15(18(21)9-17)13-24-7-3-4-8-24;1-6-2-4-7(5-3-6)11(8,9)10/h5-6,9,14,16H,3-4,7-8,10-13H2,1-2H3,(H,23,25);2-5H,1H3,(H,8,9,10)/t16-,20-;

HIDE SMILES / InChI

Molecular Formula	C20H28F2N2O
Molecular Weight	350.4459
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 `Sat Dec 16 06:45:12 UTC 2023` Edited by `admin` on `Sat Dec 16 06:45:12 UTC 2023`
Record UNII	OP970177FN
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

PF-03654764 TOSYLATE

Common Name

English

CYCLOBUTANECARBOXAMIDE, 3-FLUORO-3-(3-FLUORO-4-(1-PYRROLIDINYLMETHYL)PHENYL)-N-(2-METHYLPROPYL)-, TRANS-, 4-METHYLBENZENESULFONATE

Common Name

English

Code System Code Type Description

FDA UNII

OP970177FN

Created by admin on Sat Dec 16 06:45:12 UTC 2023 , Edited by admin on Sat Dec 16 06:45:12 UTC 2023

PRIMARY

CAS

1337536-85-2

Created by admin on Sat Dec 16 06:45:12 UTC 2023 , Edited by admin on Sat Dec 16 06:45:12 UTC 2023

NON-SPECIFIC STOICHIOMETRY

PUBCHEM

56648313

Created by admin on Sat Dec 16 06:45:12 UTC 2023 , Edited by admin on Sat Dec 16 06:45:12 UTC 2023

PRIMARY

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