Vorbipiprant, (+/-)-

Details

Stereochemistry	RACEMIC
Molecular Formula	C26H27F3N2O3
Molecular Weight	472.4994
Optical Activity	( + / - )
Defined Stereocenters	0 / 1
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure Search

SMILES

OC(=O)C1=CC=C(C=C1)C2(CC2)NC(=O)C3CC4(CC4)CCN3CC5=CC=C(C=C5)C(F)(F)F

InChI

InChIKey=CADWTPLFEZSAHM-UHFFFAOYSA-N

InChI=1S/C26H27F3N2O3/c27-26(28,29)20-5-1-17(2-6-20)16-31-14-13-24(9-10-24)15-21(31)22(32)30-25(11-12-25)19-7-3-18(4-8-19)23(33)34/h1-8,21H,9-16H2,(H,30,32)(H,33,34)

HIDE SMILES / InChI

Molecular Formula	C26H27F3N2O3
Molecular Weight	472.4994
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 `Wed Apr 02 20:52:45 GMT 2025` Edited by `admin` on `Wed Apr 02 20:52:45 GMT 2025`
Record UNII	TNK4EB6VB5
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

Vorbipiprant, (+/-)-

Common Name

English

4-[1-[[[6-[[4-(Trifluoromethyl)phenyl]methyl]-6-azaspiro[2.5]oct-5-yl]carbonyl]amino]cyclopropyl]benzoic acid

Preferred Name

English

Benzoic acid, 4-[1-[[[6-[[4-(trifluoromethyl)phenyl]methyl]-6-azaspiro[2.5]oct-5-yl]carbonyl]amino]cyclopropyl]-

Systematic Name

English

Code System Code Type Description

CAS

1417742-86-9

Created by admin on Wed Apr 02 20:52:45 GMT 2025 , Edited by admin on Wed Apr 02 20:52:45 GMT 2025

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FDA UNII

TNK4EB6VB5

Created by admin on Wed Apr 02 20:52:45 GMT 2025 , Edited by admin on Wed Apr 02 20:52:45 GMT 2025

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PUBCHEM

71186236

Created by admin on Wed Apr 02 20:52:45 GMT 2025 , Edited by admin on Wed Apr 02 20:52:45 GMT 2025

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