THIAZOL-5-YLMETHYL ((1S,2S,4S)-4-(ACETYLAMINO)-1-BENZYL-2-HYDROXY-5-PHENYLPENTYL)CARBAMATE

Details

Stereochemistry	ABSOLUTE
Molecular Formula	C25H29N3O4S
Molecular Weight	467.58
Optical Activity	UNSPECIFIED
Defined Stereocenters	3 / 3
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of THIAZOL-5-YLMETHYL ((1S,2S,4S)-4-(ACETYLAMINO)-1-BENZYL-2-HYDROXY-5-PHENYLPENTYL)CARBAMATE

Structure Search

SMILES

CC(=O)N[C@H](C[C@H](O)[C@H](CC1=CC=CC=C1)NC(=O)OCC2=CN=CS2)CC3=CC=CC=C3

InChI

InChIKey=LGKRKMCCXYIVTI-XWGVYQGASA-N

InChI=1S/C25H29N3O4S/c1-18(29)27-21(12-19-8-4-2-5-9-19)14-24(30)23(13-20-10-6-3-7-11-20)28-25(31)32-16-22-15-26-17-33-22/h2-11,15,17,21,23-24,30H,12-14,16H2,1H3,(H,27,29)(H,28,31)/t21-,23-,24-/m0/s1

HIDE SMILES / InChI

Molecular Formula	C25H29N3O4S
Molecular Weight	467.58
Charge	0
Count

Stereochemistry	ABSOLUTE
Additional Stereochemistry	No
Defined Stereocenters	3 / 3
E/Z Centers	0
Optical Activity	UNSPECIFIED

Approval Year

Substance Class	Chemical Created by `admin` on `Sat Dec 16 08:43:24 UTC 2023` Edited by `admin` on `Sat Dec 16 08:43:24 UTC 2023`
Record UNII	8KV2H7R99M
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

THIAZOL-5-YLMETHYL ((1S,2S,4S)-4-(ACETYLAMINO)-1-BENZYL-2-HYDROXY-5-PHENYLPENTYL)CARBAMATE

Systematic Name

English

RITONAVIR IMPURITY C [EP IMPURITY]

Common Name

English

RITONAVIR IMPURITY, ACETAMIDOALCOHOL- [USP IMPURITY]

Common Name

English

CARBAMIC ACID, N-((1S,2S,4S)-4-(ACETYLAMINO)-2-HYDROXY-5-PHENYL-1-(PHENYLMETHYL)PENTYL)-, 5-THIAZOLYLMETHYL ESTER

Systematic Name

English

1,3-THIAZOL-5-YLMETHYL N-((1S,2S,4S)-4-(ACETYLAMINO)-1-BENZYL-2-HYDROXY-5-PHENYLPENTYL)CARBAMATE

Systematic Name

English

Code System Code Type Description

CAS

1010808-43-1

Created by admin on Sat Dec 16 08:43:24 UTC 2023 , Edited by admin on Sat Dec 16 08:43:24 UTC 2023

PRIMARY

PUBCHEM

71752515

Created by admin on Sat Dec 16 08:43:24 UTC 2023 , Edited by admin on Sat Dec 16 08:43:24 UTC 2023

PRIMARY

EPA CompTox

DTXSID60143725

Created by admin on Sat Dec 16 08:43:24 UTC 2023 , Edited by admin on Sat Dec 16 08:43:24 UTC 2023

PRIMARY

FDA UNII

8KV2H7R99M

Created by admin on Sat Dec 16 08:43:24 UTC 2023 , Edited by admin on Sat Dec 16 08:43:24 UTC 2023

PRIMARY

Related Record Type Details


					O3J8G9O825

RITONAVIR

PARENT -> IMPURITY

Comments:

UNSPECIFIED

Qualification:

EP

Amount: