RO-5013853 C-11

Details

Stereochemistry	ABSOLUTE
Molecular Formula	C24H26F3NO5S
Molecular Weight	496.528
Optical Activity	UNSPECIFIED
Defined Stereocenters	1 / 1
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure Search

SMILES

C[C@H](OC1=C(C=C(C=C1)S([11CH3])(=O)=O)C(=O)N2CC3=CC=C(C=C3C2)C4CCOCC4)C(F)(F)F

InChI

InChIKey=IHLMQHFPWQMCHB-QTIJPIMZSA-N

InChI=1S/C24H26F3NO5S/c1-15(24(25,26)27)33-22-6-5-20(34(2,30)31)12-21(22)23(29)28-13-18-4-3-17(11-19(18)14-28)16-7-9-32-10-8-16/h3-6,11-12,15-16H,7-10,13-14H2,1-2H3/t15-/m0/s1/i2-1

HIDE SMILES / InChI

Molecular Formula	C24H26F3NO5S
Molecular Weight	496.528
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 `Sat Dec 16 14:06:22 GMT 2023` Edited by `admin` on `Sat Dec 16 14:06:22 GMT 2023`
Record UNII	L5DU2AZ7N2
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

RO-5013853 C-11

Code

English

(11C)RO-5013853

Code

English

METHANONE, (1,3-DIHYDRO-5-(TETRAHYDRO-2H-PYRAN-4-YL)-2H-ISOINDOL-2-YL)(5-(METHYL-11C-SULFONYL)-2-((1S)-2,2,2-TRIFLUORO-1-METHYLETHOXY)PHENYL)-

Systematic Name

English

11C-RO5013853

Code

English

RO5013853 C-11

Code

English

Code System Code Type Description

FDA UNII

L5DU2AZ7N2

Created by admin on Sat Dec 16 14:06:22 GMT 2023 , Edited by admin on Sat Dec 16 14:06:22 GMT 2023

PRIMARY

CAS

1224933-67-8

Created by admin on Sat Dec 16 14:06:22 GMT 2023 , Edited by admin on Sat Dec 16 14:06:22 GMT 2023

PRIMARY

PUBCHEM

46209180

Created by admin on Sat Dec 16 14:06:22 GMT 2023 , Edited by admin on Sat Dec 16 14:06:22 GMT 2023

PRIMARY

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