PULRODEMSTAT

Details

Stereochemistry	ACHIRAL
Molecular Formula	C24H23F2N5O2
Molecular Weight	451.4685
Optical Activity	NONE
Defined Stereocenters	0 / 0
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure Search

SMILES

COC1=CC=C(C=C1F)C2=C(N=C(N3CCC(N)CC3)N(C)C2=O)C4=CC(F)=C(C=C4)C#N

InChI

InChIKey=NBAIXBAUHIQQGF-UHFFFAOYSA-N

InChI=1S/C24H23F2N5O2/c1-30-23(32)21(14-5-6-20(33-2)19(26)11-14)22(15-3-4-16(13-27)18(25)12-15)29-24(30)31-9-7-17(28)8-10-31/h3-6,11-12,17H,7-10,28H2,1-2H3

HIDE SMILES / InChI

Molecular Formula	C24H23F2N5O2
Molecular Weight	451.4685
Charge	0
Count

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

Approval Year

Substance Class	Chemical Created by `admin` on `Sat Dec 16 15:15:01 UTC 2023` Edited by `admin` on `Sat Dec 16 15:15:01 UTC 2023`
Record UNII	W6F4FRQ5QC
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

PULRODEMSTAT

Official Name

English

BENZONITRILE, 4-(2-(4-AMINO-1-PIPERIDINYL)-5-(3-FLUORO-4-METHOXYPHENYL)-1,6-DIHYDRO-1-METHYL-6-OXO-4-PYRIMIDINYL)-2-FLUORO-

Systematic Name

English

CC-90011 FREE BASE

Code

English

pulrodemstat [INN]

Common Name

English

4-(2-(4-AMINO-PIPERIDIN-1-YL)-5-(3-FLUORO-4-METHOXYPHENYL)-1-METHYL-6-OXO-1,6-DIHYDROPYRIMIDIN-4-YL)-2-FLUOROBENZONITRILE

Systematic Name

English

Code System Code Type Description

CAS

1821307-10-1