4-FLUORO-5-(6-((2R)-2-HYDROXYPROPOXY)-5-METHYL-PYRROLO(2,1-F)(1,2,4)TRIAZIN-4-YL)OXY-1H-INDOLE-2-CARBOXYLIC ACID

Details

Stereochemistry	ABSOLUTE
Molecular Formula	C19H17FN4O5
Molecular Weight	400.3605
Optical Activity	UNSPECIFIED
Defined Stereocenters	1 / 1
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of 4-FLUORO-5-(6-((2R)-2-HYDROXYPROPOXY)-5-METHYL-PYRROLO(2,1-F)(1,2,4)TRIAZIN-4-YL)OXY-1H-INDOLE-2-CARBOXYLIC ACID

Structure Search

SMILES

C[C@@H](O)COC1=CN2N=CN=C(OC3=C(F)C4=C(NC(=C4)C(O)=O)C=C3)C2=C1C

InChI

InChIKey=JEFQSGODDXULMW-SECBINFHSA-N

InChI=1S/C19H17FN4O5/c1-9(25)7-28-15-6-24-17(10(15)2)18(21-8-22-24)29-14-4-3-12-11(16(14)20)5-13(23-12)19(26)27/h3-6,8-9,23,25H,7H2,1-2H3,(H,26,27)/t9-/m1/s1

HIDE SMILES / InChI

Molecular Formula	C19H17FN4O5
Molecular Weight	400.3605
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 16:09:53 UTC 2023` Edited by `admin` on `Sat Dec 16 16:09:53 UTC 2023`
Record UNII	HU7MC66574
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

4-FLUORO-5-(6-((2R)-2-HYDROXYPROPOXY)-5-METHYL-PYRROLO(2,1-F)(1,2,4)TRIAZIN-4-YL)OXY-1H-INDOLE-2-CARBOXYLIC ACID

Systematic Name

English

BRIVANIB METABOLITE M26

Common Name

English

Code System Code Type Description

PUBCHEM

118753064

Created by admin on Sat Dec 16 16:09:54 UTC 2023 , Edited by admin on Sat Dec 16 16:09:54 UTC 2023

PRIMARY

FDA UNII

HU7MC66574

Created by admin on Sat Dec 16 16:09:54 UTC 2023 , Edited by admin on Sat Dec 16 16:09:54 UTC 2023

PRIMARY

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