ATECEGATRAN

Details

Stereochemistry	ABSOLUTE
Molecular Formula	C21H21ClF2N4O4
Molecular Weight	466.866
Optical Activity	UNSPECIFIED
Defined Stereocenters	2 / 2
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure Search

SMILES

NC(=N)C1=CC=C(CNC(=O)[C@@H]2CCN2C(=O)[C@H](O)C3=CC(Cl)=CC(OC(F)F)=C3)C=C1

InChI

InChIKey=QTUUCFVBSVJGOH-DLBZAZTESA-N

InChI=1S/C21H21ClF2N4O4/c22-14-7-13(8-15(9-14)32-21(23)24)17(29)20(31)28-6-5-16(28)19(30)27-10-11-1-3-12(4-2-11)18(25)26/h1-4,7-9,16-17,21,29H,5-6,10H2,(H3,25,26)(H,27,30)/t16-,17+/m0/s1

HIDE SMILES / InChI

Molecular Formula	C21H21ClF2N4O4
Molecular Weight	466.866
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 `Fri Dec 15 20:37:53 UTC 2023` Edited by `admin` on `Fri Dec 15 20:37:53 UTC 2023`
Record UNII	497U7679T0
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

ATECEGATRAN

Official Name

English

AR-H067637

Code

English

AR-H-067637

Code

English

ARH-067637

Code

English

AR-H 067637

Code

English

atecegatran [INN]

Common Name

English

(2S)-N-((4-CARBAMIMIDOYLPHENYL)METHYL)-1-((2R)-2-(3-CHLORO-5-(DIFLUOROMETHOXY)PHENYL)-2-HYDROXYACETYL)AZETIDINE-2-CARBOXAMIDE

Systematic Name

English

2-AZETIDINECARBOXAMIDE, N-((4-(AMINOIMINOMETHYL)PHENYL)METHYL)-1-((2R)-2-(3-CHLORO-5-(DIFLUOROMETHOXY)PHENYL)-2-HYDROXYACETYL)-

Systematic Name

English

(2S)-N-((4-(AMINOIMINOMETHYL)PHENYL)METHYL)-1-((2R)-2-(3-CHLORO-5-(DIFLUOROMETHOXY)PHENYL)-2-HYDROXYACETYL)-2-AZETIDINECARBOXAMIDE

Systematic Name

English

Atecegatran [WHO-DD]

Common Name

English

Code System Code Type Description

CAS

433937-74-7