SOFINICLINE BESYLATE

Details

Stereochemistry	ABSOLUTE
Molecular Formula	C10H11Cl2N3.C6H6O3S
Molecular Weight	402.295
Optical Activity	UNSPECIFIED
Defined Stereocenters	2 / 2
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure Search

SMILES

OS(=O)(=O)C1=CC=CC=C1.[H][C@@]23CN[C@]2([H])CN(C3)C4=CC(Cl)=C(Cl)N=C4

InChI

InChIKey=QDWNBBFBKYGQFG-RDNZEXAOSA-N

InChI=1S/C10H11Cl2N3.C6H6O3S/c11-8-1-7(3-14-10(8)12)15-4-6-2-13-9(6)5-15;7-10(8,9)6-4-2-1-3-5-6/h1,3,6,9,13H,2,4-5H2;1-5H,(H,7,8,9)/t6-,9+;/m0./s1

HIDE SMILES / InChI

Molecular Formula	C6H6O3S
Molecular Weight	158.175
Charge	0
Count

Stereochemistry	ACHIRAL
Additional Stereochemistry	No
Defined Stereocenters	0 / 0
E/Z Centers	0
Optical Activity	NONE

Molecular Formula	C10H11Cl2N3
Molecular Weight	244.12
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 16:36:58 UTC 2023` Edited by `admin` on `Fri Dec 15 16:36:58 UTC 2023`
Record UNII	G889I438OQ
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

SOFINICLINE BESYLATE

Common Name

English

SOFINICLINE BENZENESULFONATE

Preferred Name

English

A-422894.112

Code

English

SOFINICLINE BESILATE

Common Name

English

SOFINICLINE BESYLATE [USAN]

Common Name

English

(-)-(1S,5S)-3-(5,6-DICHLOROPYRIDIN-3-YL)-3,6-DIAZABICYCLO(3.2.0)HEPTANE MONOBENZENESULFONATE

Systematic Name

English

(-)-(1S,5S)-3-(5,6-DICHLOROPYRIDIN-3-YL)-3,6-DIAZABICYCLO(3.2.0)HEPTANE MONOBENZENESULPHONATE

Systematic Name

English

SOFINICLINE BENZENESULPHONATE

Common Name

English

3,6-DIAZABICYCLO(3.2.0)HEPTANE, 3-(5,6-DICHLORO-3-PYRIDINYL)-, (1S,5S)-, MONOBENZENESULPHONATE

Systematic Name

English

3,6-DIAZABICYCLO(3.2.0)HEPTANE, 3-(5,6-DICHLORO-3-PYRIDINYL)-, (1S,5S)-, MONOBENZENESULFONATE

Systematic Name

English

Classification Tree Code System Code

NCI_THESAURUS

C73579