DPC-681

Details

Stereochemistry	ABSOLUTE
Molecular Formula	C35H48FN5O5S
Molecular Weight	669.85
Optical Activity	UNSPECIFIED
Defined Stereocenters	3 / 3
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure Search

SMILES

CC(C)CN(C[C@@H](O)[C@H](CC1=CC=CC=C1)N([C@H](C(N)=O)C(C)(C)C)C(=O)CNCC2=CC=CC(F)=C2)S(=O)(=O)C3=CC=CC(N)=C3

InChI

InChIKey=VAXRCFUMOHKDCQ-RKKDRKJOSA-N

InChI=1S/C35H48FN5O5S/c1-24(2)22-40(47(45,46)29-16-10-15-28(37)19-29)23-31(42)30(18-25-11-7-6-8-12-25)41(33(34(38)44)35(3,4)5)32(43)21-39-20-26-13-9-14-27(36)17-26/h6-17,19,24,30-31,33,39,42H,18,20-23,37H2,1-5H3,(H2,38,44)/t30-,31+,33+/m0/s1

HIDE SMILES / InChI

Molecular Formula	C35H48FN5O5S
Molecular Weight	669.85
Charge	0
Count

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

Approval Year

Targets

Primary Target	Pharmacology	Condition	Potency
HIV protease 2 Target ID: HIV protease Sources: https://www.ncbi.nlm.nih.gov/pubmed/11600351	Inhibitor 8297

Substance Class	Chemical Created by `admin` on `Sat Dec 16 08:26:51 GMT 2023` Edited by `admin` on `Sat Dec 16 08:26:51 GMT 2023`
Record UNII	KV8K47D5MM
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

DPC-681

Code

English

DPC681

Code

English

N-((3-FLUOROPHENYL)METHYL)GLYCYL-N-((1S,2R)-3-(((3-AMINOPHENYL)SULFONYL)(2-METHYLPROPYL)AMINO)-2-HYDROXY-1-(PHENYLMETHYL)PROPYL)-3-METHYL-L-VALINAMIDE

Systematic Name

English

DPH-153893

Code

English

(2S)-N-((1S,2R)-3-((3-AMINOPHENYL)SULFONYL-ISOBUTYL-AMINO)-1-BENZYL-2-HYDROXY-PROPYL)-2-((2-((3-FLUOROPHENYL)METHYLAMINO)ACETYL)AMINO)-3,3-DIMETHYL-BUTANAMIDE

Systematic Name

English

L-VALINAMIDE, N-((3-FLUOROPHENYL)METHYL)GLYCYL-N-((1S,2R)-3-(((3-AMINOPHENYL)SULFONYL)(2-METHYLPROPYL)AMINO)-2-HYDROXY-1-(PHENYLMETHYL)PROPYL)-3-METHYL-

Systematic Name

English

Code System Code Type Description

FDA UNII

KV8K47D5MM