5'-DEOXY-2,5'-DICHLORO-N6-(4-(2-PYRIDYLSULFANYL)PIPERIDIN-1-YL)ADENOSINE

Details

Stereochemistry	ABSOLUTE
Molecular Formula	C20H23Cl2N7O3S
Molecular Weight	512.413
Optical Activity	UNSPECIFIED
Defined Stereocenters	4 / 4
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of 5'-DEOXY-2,5'-DICHLORO-N6-(4-(2-PYRIDYLSULFANYL)PIPERIDIN-1-YL)ADENOSINE

Structure Search

SMILES

O[C@@H]1[C@@H](CCl)O[C@H]([C@@H]1O)N2C=NC3=C(NN4CCC(CC4)SC5=NC=CC=C5)N=C(Cl)N=C23

InChI

InChIKey=KTMAAJSSPPJOJM-BGIGGGFGSA-N

InChI=1S/C20H23Cl2N7O3S/c21-9-12-15(30)16(31)19(32-12)29-10-24-14-17(25-20(22)26-18(14)29)27-28-7-4-11(5-8-28)33-13-3-1-2-6-23-13/h1-3,6,10-12,15-16,19,30-31H,4-5,7-9H2,(H,25,26,27)/t12-,15-,16-,19-/m1/s1

HIDE SMILES / InChI

Molecular Formula	C20H23Cl2N7O3S
Molecular Weight	512.413
Charge	0
Count

Stereochemistry	ABSOLUTE
Additional Stereochemistry	No
Defined Stereocenters	4 / 4
E/Z Centers	0
Optical Activity	UNSPECIFIED

Approval Year

Substance Class	Chemical Created by `admin` on `Sat Dec 16 09:44:33 GMT 2023` Edited by `admin` on `Sat Dec 16 09:44:33 GMT 2023`
Record UNII	57379UMX9H
Record Status	`Validated (UNII)`
Record Version

Download

Name

Type

Language

5'-DEOXY-2,5'-DICHLORO-N6-(4-(2-PYRIDYLSULFANYL)PIPERIDIN-1-YL)ADENOSINE

Systematic Name

English

NNC-21-0300

Code

English

ADENOSINE, 2,5'-DICHLORO-5'-DEOXY-N-(4-(2-PYRIDINYLTHIO)-1-PIPERIDINYL)-

Systematic Name

English

Code System Code Type Description

CAS

206270-32-8

Created by admin on Sat Dec 16 09:44:33 GMT 2023 , Edited by admin on Sat Dec 16 09:44:33 GMT 2023

PRIMARY

FDA UNII

57379UMX9H

Created by admin on Sat Dec 16 09:44:33 GMT 2023 , Edited by admin on Sat Dec 16 09:44:33 GMT 2023

PRIMARY

PUBCHEM

54012688

Created by admin on Sat Dec 16 09:44:33 GMT 2023 , Edited by admin on Sat Dec 16 09:44:33 GMT 2023

PRIMARY

Related Record Type Details


					57379UMX9H

5'-DEOXY-2,5'-DICHLORO-N6-(4-(2-PYRIDYLSULFANYL)PIPERIDIN-1-YL)ADENOSINE

ACTIVE MOIETY