ULIXERTINIB HYDROCHLORIDE

Details

Stereochemistry	ABSOLUTE
Molecular Formula	C21H22Cl2N4O2.ClH
Molecular Weight	469.792
Optical Activity	UNSPECIFIED
Defined Stereocenters	1 / 1
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure Search

SMILES

Cl.CC(C)NC1=CC(C2=CNC(=C2)C(=O)N[C@H](CO)C3=CC(Cl)=CC=C3)=C(Cl)C=N1

InChI

InChIKey=DKGYQCPFBWFTHM-FSRHSHDFSA-N

InChI=1S/C21H22Cl2N4O2.ClH/c1-12(2)26-20-8-16(17(23)10-25-20)14-7-18(24-9-14)21(29)27-19(11-28)13-4-3-5-15(22)6-13;/h3-10,12,19,24,28H,11H2,1-2H3,(H,25,26)(H,27,29);1H/t19-;/m1./s1

HIDE SMILES / InChI

Molecular Formula	ClH
Molecular Weight	36.461
Charge	0
Count

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

Molecular Formula	C21H22Cl2N4O2
Molecular Weight	433.331
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 06:39:24 UTC 2023` Edited by `admin` on `Sat Dec 16 06:39:24 UTC 2023`
Record UNII	3K792HRQ8B
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

ULIXERTINIB HYDROCHLORIDE

Common Name

English

(S)-4-(5-CHLORO-2-(ISOPROPYLAMINO)PYRIDIN-4-YL)-N-(1-(3-CHLOROPHENYL)-2-HYDROXYETHYL)-1H-PYRROLE-2-CARBOXAMIDE HYDROCHLORIDE

Systematic Name

English

1H-PYRROLE-2-CARBOXAMIDE, 4-(5-CHLORO-2-((1-METHYLETHYL)AMINO)-4-PYRIDINYL)-N-((1S)-1-(3-CHLOROPHENYL)-2-HYDROXYETHYL)-, HYDROCHLORIDE (1:1)

Systematic Name

English

Classification Tree Code System Code

FDA ORPHAN DRUG

398213