MK-2048

Details

Stereochemistry	ABSOLUTE
Molecular Formula	C21H21ClFN5O4
Molecular Weight	461.874
Optical Activity	UNSPECIFIED
Defined Stereocenters	1 / 1
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure Search

SMILES

CCN1C[C@H](C)N2C(=C(O)C3=C2C(=NN(CC4=CC=C(F)C(Cl)=C4)C3=O)C(=O)NC)C1=O

InChI

InChIKey=JSRREMIKIHJGAA-JTQLQIEISA-N

InChI=1S/C21H21ClFN5O4/c1-4-26-8-10(2)28-16-14(18(29)17(28)21(26)32)20(31)27(25-15(16)19(30)24-3)9-11-5-6-13(23)12(22)7-11/h5-7,10,29H,4,8-9H2,1-3H3,(H,24,30)/t10-/m0/s1

HIDE SMILES / InChI

Molecular Formula	C21H21ClFN5O4
Molecular Weight	461.874
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 01:30:40 UTC 2023` Edited by `admin` on `Sat Dec 16 01:30:40 UTC 2023`
Record UNII	LJ8U884TM5
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

MK-2048

Common Name

English

Pyrazino[1′,2′:1,5]pyrrolo[2,3-d]pyridazine-4-carboxamide, 2-[(3-chloro-4-fluorophenyl)methyl]-8-ethyl-1,2,6,7,8,9-hexahydro-10-hydroxy-N,6-dimethyl-1,9-dioxo-, (6S)-

Systematic Name

English

(6S)-2-[(3-Chloro-4-fluorophenyl)methyl]-8-ethyl-1,2,6,7,8,9-hexahydro-10-hydroxy-N,6-dimethyl-1,9-dioxopyrazino[1′,2′:1,5]pyrrolo[2,3-d]pyridazine-4-carboxamide

Systematic Name

English

Code System Code Type Description

EPA CompTox

DTXSID70236031