BEFOTERTINIB MONOMESYLATE

Details

Stereochemistry	ACHIRAL
Molecular Formula	C29H32F3N7O2.CH4O3S
Molecular Weight	663.711
Optical Activity	NONE
Defined Stereocenters	0 / 0
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure Search

SMILES

CS(O)(=O)=O.COC1=C(NC2=NC=CC(=N2)C3=CN(CC(F)(F)F)C4=CC=CC=C34)C=C(NC(=O)C=C)C(=C1)N(C)CCN(C)C

InChI

InChIKey=FFQDXZLQXPZZDJ-UHFFFAOYSA-N

InChI=1S/C29H32F3N7O2.CH4O3S/c1-6-27(40)34-22-15-23(26(41-5)16-25(22)38(4)14-13-37(2)3)36-28-33-12-11-21(35-28)20-17-39(18-29(30,31)32)24-10-8-7-9-19(20)24;1-5(2,3)4/h6-12,15-17H,1,13-14,18H2,2-5H3,(H,34,40)(H,33,35,36);1H3,(H,2,3,4)

HIDE SMILES / InChI

Molecular Formula	C29H32F3N7O2
Molecular Weight	567.6053
Charge	0
Count

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

Molecular Formula	CH4O3S
Molecular Weight	96.106
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 16:46:18 UTC 2023` Edited by `admin` on `Sat Dec 16 16:46:18 UTC 2023`
Record UNII	QKN83970TH
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

BEFOTERTINIB MONOMESYLATE

Common Name

English

BEFOTERTINIB MESYLATE

Common Name

English

2-PROPENAMIDE, N-(2-((2-(DIMETHYLAMINO)ETHYL)METHYLAMINO)-4-METHOXY-5-((4-(1-(2,2,2-TRIFLUOROETHYL)-1H-INDOL-3-YL)-2-PYRIMIDINYL)AMINO)PHENYL)-, COMPD. WITH METHANESULFONATE (1:1)

Common Name

English

BEFOTERTINIB MONOMESILATE

Common Name

English

N-(2-((2-(DIMETHYLAMINO)ETHYL)(METHYL)AMINO)-4-METHOXY-5-((4-(1-(2,2,2-TRIFLUOROETHYL)-1H-INDOL-3-YL)PYRIMIDIN-2-YL)AMINO)PHENYL)PROP-2-ENAMIDE MONOMESYLATE

Systematic Name

English

Code System Code Type Description

CAS

2226167-02-6

Created by admin on Sat Dec 16 16:46:19 UTC 2023 , Edited by admin on Sat Dec 16 16:46:19 UTC 2023

PRIMARY

PUBCHEM

154572829

Created by admin on Sat Dec 16 16:46:19 UTC 2023 , Edited by admin on Sat Dec 16 16:46:19 UTC 2023

PRIMARY

FDA UNII

QKN83970TH

Created by admin on Sat Dec 16 16:46:19 UTC 2023 , Edited by admin on Sat Dec 16 16:46:19 UTC 2023

PRIMARY

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