CARSATRIN SUCCINATE

Details

Stereochemistry	RACEMIC
Molecular Formula	C25H26F2N6OS.C4H6O4
Molecular Weight	614.663
Optical Activity	( + / - )
Defined Stereocenters	0 / 1
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure Search

SMILES

OC(=O)CCC(O)=O.OC(CSC1=C2N=CN=C2N=CN1)CN3CCN(CC3)C(C4=CC=C(F)C=C4)C5=CC=C(F)C=C5

InChI

InChIKey=HITUQCDKZKCYIZ-UHFFFAOYSA-N

InChI=1S/C25H26F2N6OS.C4H6O4/c26-19-5-1-17(2-6-19)23(18-3-7-20(27)8-4-18)33-11-9-32(10-12-33)13-21(34)14-35-25-22-24(29-15-28-22)30-16-31-25;5-3(6)1-2-4(7)8/h1-8,15-16,21,23,34H,9-14H2,(H,28,29,30,31);1-2H2,(H,5,6)(H,7,8)

HIDE SMILES / InChI

Molecular Formula	C4H6O4
Molecular Weight	118.088
Charge	0
Count

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

Molecular Formula	C25H26F2N6OS
Molecular Weight	496.575
Charge	0
Count

Stereochemistry	RACEMIC
Additional Stereochemistry	No
Defined Stereocenters	0 / 1
E/Z Centers	0
Optical Activity	( + / - )

Approval Year

Substance Class	Chemical Created by `admin` on `Fri Dec 15 16:32:52 UTC 2023` Edited by `admin` on `Fri Dec 15 16:32:52 UTC 2023`
Record UNII	YAZ544QOFD
Record Status	`Validated (UNII)`
Record Version

Download

Name

Type

Language

CARSATRIN SUCCINATE

Official Name

English

CARSATRIN SUCCINATE [USAN]

Common Name

English

RWJ-24517

Code

English

RWJ 24517

Code

English

1-PIPERAZINEETHANOL, 4-(BIS(4-FLUOROPHENYL)METHYL)-.ALPHA.-((9H-PURIN-6-YLTHIO)METHYL)-, (±)-, BUTANEDIOATE (1:1) (SALT)

Common Name

English

Classification Tree Code System Code

NCI_THESAURUS

C78322