CP-547632

Details

Stereochemistry	ACHIRAL
Molecular Formula	C20H24BrF2N5O3S
Molecular Weight	532.402
Optical Activity	NONE
Defined Stereocenters	0 / 0
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure Search

SMILES

NC(=O)C1=C(NC(=O)NCCCCN2CCCC2)SN=C1OCC3=C(F)C=C(Br)C=C3F

InChI

InChIKey=HXHAJRMTJXHJJZ-UHFFFAOYSA-N

InChI=1S/C20H24BrF2N5O3S/c21-12-9-14(22)13(15(23)10-12)11-31-18-16(17(24)29)19(32-27-18)26-20(30)25-5-1-2-6-28-7-3-4-8-28/h9-10H,1-8,11H2,(H2,24,29)(H2,25,26,30)

HIDE SMILES / InChI

Molecular Formula	C20H24BrF2N5O3S
Molecular Weight	532.402
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 18:07:48 UTC 2023` Edited by `admin` on `Fri Dec 15 18:07:48 UTC 2023`
Record UNII	W1B375O5M2
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

CP-547632

Common Name

English

CP-547,632

Code

English

PAN-90806

Code

English

CP-632

Code

English

OSI-632

Code

English

PAN 90806

Code

English

4-ISOTHIAZOLECARBOXAMIDE, 3-((4-BROMO-2,6-DIFLUOROPHENYL)METHOXY)-5-((((4-(1-PYRROLIDINYL)BUTYL)AMINO)CARBONYL)AMINO)-

Systematic Name

English

PAN90806

Code

English

Classification Tree Code System Code

NCI_THESAURUS

C1967