INUPADENANT, (±)-

Details

Stereochemistry	RACEMIC
Molecular Formula	C25H26F2N8O4S2
Molecular Weight	604.652
Optical Activity	( + / - )
Defined Stereocenters	0 / 1
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure Search

SMILES

C[S+]([O-])CCOC1=C(F)C=C(F)C(=C1)N2CCN(CCN3C(=O)SC4=C3N=C(N)N5N=C(N=C45)C6=CC=CO6)CC2

InChI

InChIKey=QYCCLUSYHJXDEX-UHFFFAOYSA-N

InChI=1S/C25H26F2N8O4S2/c1-41(37)12-11-39-19-14-17(15(26)13-16(19)27)33-7-4-32(5-8-33)6-9-34-22-20(40-25(34)36)23-29-21(18-3-2-10-38-18)31-35(23)24(28)30-22/h2-3,10,13-14H,4-9,11-12H2,1H3,(H2,28,30)

HIDE SMILES / InChI

Molecular Formula	C25H26F2N8O4S2
Molecular Weight	604.652
Charge	0
Count

Stereochemistry	RACEMIC
Additional Stereochemistry	No
Defined Stereocenters	0 / 1
E/Z Centers	0
Optical Activity	( + / - )

Approval Year

Substance Class	Chemical Created by `admin` on `Sat Dec 16 14:28:44 UTC 2023` Edited by `admin` on `Sat Dec 16 14:28:44 UTC 2023`
Record UNII	L9RDR3F7GU
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

INUPADENANT, (±)-

Common Name

English

5-AMINO-3-(2-(4-(2,4-DIFLUORO-5-(2-(METHYLSULFINYL)ETHOXY)PHENYL)PIPERAZIN-1-YL)ETHYL)-8-(FURAN-2-YL)THIAZOLO(5,4-E)(1,2,4)TRIAZOLO(1,5-C)PYRIMIDIN-2(3H)-ONE

Systematic Name

English

THIAZOLO(5,4-E)(1,2,4)TRIAZOLO(1,5-C)PYRIMIDIN-2(3H)-ONE, 5-AMINO-3-(2-(4-(2,4-DIFLUORO-5-(2-(METHYLSULFINYL)ETHOXY)PHENYL)-1-PIPERAZINYL)ETHYL)-8-(2-FURANYL)-

Systematic Name

English

Code System Code Type Description

FDA UNII

L9RDR3F7GU

Created by admin on Sat Dec 16 14:28:44 UTC 2023 , Edited by admin on Sat Dec 16 14:28:44 UTC 2023

PRIMARY

CAS

2246607-06-5

Created by admin on Sat Dec 16 14:28:44 UTC 2023 , Edited by admin on Sat Dec 16 14:28:44 UTC 2023

PRIMARY

PUBCHEM