SB-435495

Details

Stereochemistry	ACHIRAL
Molecular Formula	C38H40F4N6O2S
Molecular Weight	720.822
Optical Activity	NONE
Defined Stereocenters	0 / 0
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure Search

SMILES

CCN(CC)CCN(CC1=CC=C(C=C1)C2=CC=C(C=C2)C(F)(F)F)C(=O)CN3C=C(CC4=CN(C)N=C4)C(=O)N=C3SCC5=CC=C(F)C=C5

InChI

InChIKey=VGIQUSQBXZXBGW-UHFFFAOYSA-N

InChI=1S/C38H40F4N6O2S/c1-4-46(5-2)18-19-47(23-27-6-10-30(11-7-27)31-12-14-33(15-13-31)38(40,41)42)35(49)25-48-24-32(20-29-21-43-45(3)22-29)36(50)44-37(48)51-26-28-8-16-34(39)17-9-28/h6-17,21-22,24H,4-5,18-20,23,25-26H2,1-3H3

HIDE SMILES / InChI

Molecular Formula	C38H40F4N6O2S
Molecular Weight	720.822
Charge	0
Count

Stereochemistry	ACHIRAL
Additional Stereochemistry	No
Defined Stereocenters	0 / 0
E/Z Centers	0
Optical Activity	NONE

Approval Year

Patents

Substance Class	Chemical Created by `admin` on `Fri Dec 15 15:25:43 GMT 2023` Edited by `admin` on `Fri Dec 15 15:25:43 GMT 2023`
Record UNII	0ORT6ZXL2X
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

SB-435495

Code

English

1(4H)-PYRIMIDINEACETAMIDE, N-(2-(DIETHYLAMINO)ETHYL)-2-(((4-FLUOROPHENYL)METHYL)THIO)-5-((1-METHYL-1H-PYRAZOL-4-YL)METHYL)-4-OXO-N-((4'-(TRIFLUOROMETHYL)(1,1'-BIPHENYL)-4-YL)METHYL)-

Systematic Name

English

Code System Code Type Description

CAS

304694-39-1

Created by admin on Fri Dec 15 15:25:43 GMT 2023 , Edited by admin on Fri Dec 15 15:25:43 GMT 2023

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PUBCHEM

10417440

Created by admin on Fri Dec 15 15:25:43 GMT 2023 , Edited by admin on Fri Dec 15 15:25:43 GMT 2023

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FDA UNII

0ORT6ZXL2X

Created by admin on Fri Dec 15 15:25:43 GMT 2023 , Edited by admin on Fri Dec 15 15:25:43 GMT 2023

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Related Record Type Details


					0ORT6ZXL2X

SB-435495

ACTIVE MOIETY