Atilotrelvir

Details

Stereochemistry	ABSOLUTE
Molecular Formula	C24H32F3N5O4
Molecular Weight	511.5372
Optical Activity	UNSPECIFIED
Defined Stereocenters	6 / 6
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure Search

SMILES

CC(C)(C)[C@H](NC(=O)C(F)(F)F)C(=O)N1[C@H]2C[C@@H]([C@H]1C(=O)N[C@@H](C[C@@H]3CCNC3=O)C#N)C4(CC4)C2

InChI

InChIKey=GTRJFXDJASEGSW-KBCNZALWSA-N

InChI=1S/C24H32F3N5O4/c1-22(2,3)17(31-21(36)24(25,26)27)20(35)32-14-9-15(23(10-14)5-6-23)16(32)19(34)30-13(11-28)8-12-4-7-29-18(12)33/h12-17H,4-10H2,1-3H3,(H,29,33)(H,30,34)(H,31,36)/t12-,13-,14-,15-,16-,17+/m0/s1

HIDE SMILES / InChI

Molecular Formula	C24H32F3N5O4
Molecular Weight	511.5372
Charge	0
Count

Stereochemistry	ABSOLUTE
Additional Stereochemistry	No
Defined Stereocenters	6 / 6
E/Z Centers	0
Optical Activity	UNSPECIFIED

Approval Year

Substance Class	Chemical Created by `admin` on `Wed Apr 02 18:03:59 GMT 2025` Edited by `admin` on `Wed Apr 02 18:03:59 GMT 2025`
Record UNII	JVV7PSN6VL
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

Atilotrelvir

Official Name

English

Atilotrelvir [WHO-DD]

Preferred Name

English

atilotrelvir [INN]

Common Name

English

(1R,4S,6S)-N-{(1S)-1-ciano-2-[(3S)-2-oxopirrolidin-3-il]etil}-5-[(2S)-3,3-dimetil-2-(2,2,2-trifluoroacetamido)butanoil]-5-azaespiro[biciclo[2.2.1]heptano-2,1'-ciclopropano]-6-carboxamida

Systematic Name

English

Spiro[2-azabicyclo[2.2.1]heptane-5,1?-cyclopropane]-3-carboxamide, N-[(1S)-1-cyano-2-[(3S)-2-oxo-3-pyrrolidinyl]ethyl]-2-[(2S)-3,3-dimethyl-1-oxo-2-[(2,2,2-trifluoroacetyl)amino]butyl]-, (1S,3S,4R)-

Systematic Name

English

Code System Code Type Description

SMS_ID

300000051716