BAVDEGALUTAMIDE

Details

Stereochemistry	EPIMERIC
Molecular Formula	C41H43ClFN9O6
Molecular Weight	812.288
Optical Activity	UNSPECIFIED
Defined Stereocenters	2 / 3
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure Search

SMILES

FC1=CC2=C(C=C1N3CCN(CC4CCN(CC4)C5=NN=C(C=C5)C(=O)N[C@H]6CC[C@@H](CC6)OC7=CC=C(C#N)C(Cl)=C7)CC3)C(=O)N(C8CCC(=O)NC8=O)C2=O

InChI

InChIKey=CLCTZVRHDOAUGJ-SYVGMNBRSA-N

InChI=1S/C41H43ClFN9O6/c42-31-19-28(4-1-25(31)22-44)58-27-5-2-26(3-6-27)45-38(54)33-7-9-36(48-47-33)51-13-11-24(12-14-51)23-49-15-17-50(18-16-49)35-21-30-29(20-32(35)43)40(56)52(41(30)57)34-8-10-37(53)46-39(34)55/h1,4,7,9,19-21,24,26-27,34H,2-3,5-6,8,10-18,23H2,(H,45,54)(H,46,53,55)/t26-,27-,34?

HIDE SMILES / InChI

Molecular Formula	C41H43ClFN9O6
Molecular Weight	812.288
Charge	0
Count

Stereochemistry	EPIMERIC
Additional Stereochemistry	No
Defined Stereocenters	2 / 3
E/Z Centers	0
Optical Activity	UNSPECIFIED

Approval Year

Substance Class	Chemical Created by `admin` on `Sat Dec 16 14:24:11 GMT 2023` Edited by `admin` on `Sat Dec 16 14:24:11 GMT 2023`
Record UNII	H6NYM0V650
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

BAVDEGALUTAMIDE

Official Name

English

3-PYRIDAZINECARBOXAMIDE, N-(TRANS-4-(3-CHLORO-4-CYANOPHENOXY)CYCLOHEXYL)-6-(4-((4-(2-(2,6-DIOXO-3-PIPERIDINYL)-6-FLUORO-2,3-DIHYDRO-1,3-DIOXO-1H-ISOINDOL-5-YL)-1-PIPERAZINYL)METHYL)-1-PIPERIDINYL)-

Systematic Name

English

Bavdegalutamide [WHO-DD]

Common Name

English

BAVDEGALUTAMIDE [USAN]

Common Name

English

ARV-110 (PROTAC)

Code

English

N-((1R,4R)-4-(3-CHLORO-4-CYANOPHENOXY)CYCLOHEXYL)-6-(4-((4-(2-(2,6-DIOXOPIPERIDIN-3-YL)-6-FLUORO-1,3-DIOXO-2,3-DIHYDRO-1H-ISOINDOL-5-YL)PIPERAZIN-1-YL)METHYL)PIPERIDIN-1-YL)PYRIDAZINE-3-CARBOXAMIDE

Systematic Name

English

bavdegalutamide [INN]

Common Name

English

ARV-110

Code

English

ARV110

Code

English

Code System Code Type Description

CAS

2222112-77-6