Anizatrectinib

Details

Stereochemistry	ABSOLUTE
Molecular Formula	C29H32FN7O2
Molecular Weight	529.6085
Optical Activity	UNSPECIFIED
Defined Stereocenters	2 / 2
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure Search

SMILES

[H][C@]1(CN(CCOC)C[C@H]1NC(=O)NC2=C(C)C(=NN2C3=CC=CC=C3)C4=CN=C(C)N=C4)C5=CC(F)=CC=C5

InChI

InChIKey=BGKSBHPSVMJTFL-IZZNHLLZSA-N

InChI=1S/C29H32FN7O2/c1-19-27(22-15-31-20(2)32-16-22)35-37(24-10-5-4-6-11-24)28(19)34-29(38)33-26-18-36(12-13-39-3)17-25(26)21-8-7-9-23(30)14-21/h4-11,14-16,25-26H,12-13,17-18H2,1-3H3,(H2,33,34,38)/t25-,26+/m0/s1

HIDE SMILES / InChI

Molecular Formula	C29H32FN7O2
Molecular Weight	529.6085
Charge	0
Count

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

Approval Year

Substance Class	Chemical Created by `admin` on `Sat Dec 16 19:17:34 GMT 2023` Edited by `admin` on `Sat Dec 16 19:17:34 GMT 2023`
Record UNII	4D7KT2X8U2
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

Anizatrectinib

Official Name

English

anizatrectinib [INN]

Common Name

English

N-[(3S,4R)-4-(3-Fluorophenyl)-1-(2-methoxyethyl)-3-pyrrolidinyl]-N′-[4-methyl-3-(2-methyl-5-pyrimidinyl)-1-phenyl-1H-pyrazol-5-yl]urea

Systematic Name

English

Urea, N-[(3S,4R)-4-(3-fluorophenyl)-1-(2-methoxyethyl)-3-pyrrolidinyl]-N′-[4-methyl-3-(2-methyl-5-pyrimidinyl)-1-phenyl-1H-pyrazol-5-yl]-

Systematic Name

English

N-[(3S,4R)-4-(3-fluorophenyl)-1-(2- methoxyethyl)pyrrolidin-3-yl]-N'-[4-methyl-3-(2- methylpyrimidin-5-yl)-1-phenyl-1H-pyrazol-5-yl]urea

Systematic Name

English

Code System Code Type Description

SMS_ID

300000047394