ACT-777991

Details

Stereochemistry	ABSOLUTE
Molecular Formula	C20H20F6N8O2S
Molecular Weight	550.481
Optical Activity	UNSPECIFIED
Defined Stereocenters	1 / 1
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure Search

SMILES

CC1=NN(CC(=O)N2CCN(C[C@H]2CCO)C3=C(N=C(S3)C(F)(F)F)C4=CN=C(N=C4)C(F)(F)F)C=N1

InChI

InChIKey=FDZFVXKCJKOSRC-CYBMUJFWSA-N

InChI=1S/C20H20F6N8O2S/c1-11-29-10-33(31-11)9-14(36)34-4-3-32(8-13(34)2-5-35)16-15(30-18(37-16)20(24,25)26)12-6-27-17(28-7-12)19(21,22)23/h6-7,10,13,35H,2-5,8-9H2,1H3/t13-/m1/s1

HIDE SMILES / InChI

Molecular Formula	C20H20F6N8O2S
Molecular Weight	550.481
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 20:08:29 GMT 2023` Edited by `admin` on `Sat Dec 16 20:08:29 GMT 2023`
Record UNII	B5B6YF7GWT
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

ACT-777991

Code

English

Ethanone, 1-[(2R)-2-(2-hydroxyethyl)-4-[2-(trifluoromethyl)-4-[2-(trifluoromethyl)-5-pyrimidinyl]-5-thiazolyl]-1-piperazinyl]-2-(3-methyl-1H-1,2,4-triazol-1-yl)-

Systematic Name

English

Code System Code Type Description

FDA UNII

B5B6YF7GWT

Created by admin on Sat Dec 16 20:08:31 GMT 2023 , Edited by admin on Sat Dec 16 20:08:31 GMT 2023

PRIMARY

CAS

1967811-46-6

Created by admin on Sat Dec 16 20:08:31 GMT 2023 , Edited by admin on Sat Dec 16 20:08:31 GMT 2023

PRIMARY

PUBCHEM