Tivumecirnon

Details

Stereochemistry	ABSOLUTE
Molecular Formula	C24H27Cl2F3N6O
Molecular Weight	543.412
Optical Activity	UNSPECIFIED
Defined Stereocenters	2 / 2
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure Search

SMILES

C[C@@H](N1N=C(C2=NC=C(N=C12)N3CC(C3)[C@H]4CCCN(CCO)C4)C(F)(F)F)C5=CC=C(Cl)C=C5Cl

InChI

InChIKey=AKSVALRPYDVQBS-CABCVRRESA-N

InChI=1S/C24H27Cl2F3N6O/c1-14(18-5-4-17(25)9-19(18)26)35-23-21(22(32-35)24(27,28)29)30-10-20(31-23)34-12-16(13-34)15-3-2-6-33(11-15)7-8-36/h4-5,9-10,14-16,36H,2-3,6-8,11-13H2,1H3/t14-,15+/m1/s1

HIDE SMILES / InChI

Molecular Formula	C24H27Cl2F3N6O
Molecular Weight	543.412
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 14:16:34 UTC 2023` Edited by `admin` on `Sat Dec 16 14:16:34 UTC 2023`
Record UNII	R1T69T65FJ
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

Tivumecirnon

Official Name

English

tivumecirnon [INN]

Common Name

English

1-PIPERIDINEETHANOL, 3-(1-(1-((1R)-1-(2,4-DICHLOROPHENYL)ETHYL)-3-(TRIFLUOROMETHYL)-1H-PYRAZOLO(3,4-B)PYRAZIN-6-YL)-3-AZETIDINYL)-, (3R)-

Systematic Name

English

FLX-475

Code

English

2-[(3R)-3-(1-{1-[(1R)-1-(2,4-dichlorophenyl)ethyl]-3- (trifluoromethyl)-1H-pyrazolo[3,4-b]pyrazin-6- yl}azetidin-3-yl)piperidin-1-yl]ethan-1-ol

Systematic Name

English

Code System Code Type Description

NCI_THESAURUS

C157240