NNI-351

Details

Stereochemistry	ACHIRAL
Molecular Formula	C24H24FN5OS
Molecular Weight	449.544
Optical Activity	NONE
Defined Stereocenters	0 / 0
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure Search

SMILES

CCOC1=CC2=C(C=C1)N=C(N3CCCN(CC3)C(=S)NC4=CC=CC=C4F)C(=C2)C#N

InChI

InChIKey=RQXUPDSAFGWKMO-UHFFFAOYSA-N

InChI=1S/C24H24FN5OS/c1-2-31-19-8-9-21-17(15-19)14-18(16-26)23(27-21)29-10-5-11-30(13-12-29)24(32)28-22-7-4-3-6-20(22)25/h3-4,6-9,14-15H,2,5,10-13H2,1H3,(H,28,32)

HIDE SMILES / InChI

Molecular Formula	C24H24FN5OS
Molecular Weight	449.544
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 17:24:55 UTC 2023` Edited by `admin` on `Sat Dec 16 17:24:55 UTC 2023`
Record UNII	97LG4X5P2E
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

NNI-351

Common Name

English

4-(3-cyano-6-ethoxyquinolin-2-yl)-N- (2-fluorophenyl)-1,4-diazepane-1-carbothiomide

Systematic Name

English

1H-1,4-DIAZEPINE-1-CARBOTHIOAMIDE, 4-(3-CYANO-6-ETHOXY-2-QUINOLINYL)-N-(2-FLUOROPHENYL)HEXAHYDRO-

Systematic Name

English

4-(3-CYANO-6-ETHOXY-2-QUINOLINYL)-N-(2-FLUOROPHENYL)HEXAHYDRO-1H-1,4-DIAZEPINE-1-CARBOTHIOAMIDE

Systematic Name

English

Classification Tree Code System Code

FDA ORPHAN DRUG

880622