Vemurafenib C-11

Details

Stereochemistry	ACHIRAL
Molecular Formula	C23H18ClF2N3O3S
Molecular Weight	488.923
Optical Activity	NONE
Defined Stereocenters	0 / 0
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure Search

SMILES

CCCS(=O)(=O)NC1=C(F)C(=C(F)C=C1)[11C](=O)C2=CNC3=C2C=C(C=N3)C4=CC=C(Cl)C=C4

InChI

InChIKey=GPXBXXGIAQBQNI-KVTPGWOSSA-N

InChI=1S/C23H18ClF2N3O3S/c1-2-9-33(31,32)29-19-8-7-18(25)20(21(19)26)22(30)17-12-28-23-16(17)10-14(11-27-23)13-3-5-15(24)6-4-13/h3-8,10-12,29H,2,9H2,1H3,(H,27,28)/i22-1

HIDE SMILES / InChI

Molecular Formula	C23H18ClF2N3O3S
Molecular Weight	488.923
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 `Wed Apr 02 15:03:21 GMT 2025` Edited by `admin` on `Wed Apr 02 15:03:21 GMT 2025`
Record UNII	K5SYG5875K
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

Vemurafenib C-11

Common Name

English

[11C]Vemurafenib

Preferred Name

English

Code System Code Type Description

FDA UNII

K5SYG5875K

Created by admin on Wed Apr 02 15:03:21 GMT 2025 , Edited by admin on Wed Apr 02 15:03:21 GMT 2025

PRIMARY

PUBCHEM

166177249

Created by admin on Wed Apr 02 15:03:21 GMT 2025 , Edited by admin on Wed Apr 02 15:03:21 GMT 2025

PRIMARY

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