TOREFORANT TARTRATE

Details

Stereochemistry	ABSOLUTE
Molecular Formula	2C23H32N6.C4H6O6
Molecular Weight	935.1676
Optical Activity	UNSPECIFIED
Defined Stereocenters	2 / 2
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure Search

SMILES

O[C@H]([C@@H](O)C(O)=O)C(O)=O.CN1CCC(CCCNC2=NC=C(C3=NC4=C(C)C=C(C)C=C4N3)C(C)=N2)CC1.CN5CCC(CCCNC6=NC=C(C7=NC8=C(C)C=C(C)C=C8N7)C(C)=N6)CC5

InChI

InChIKey=FWIDBLDKHORZBP-CEAXSRTFSA-N

InChI=1S/2C23H32N6.C4H6O6/c2*1-15-12-16(2)21-20(13-15)27-22(28-21)19-14-25-23(26-17(19)3)24-9-5-6-18-7-10-29(4)11-8-18;5-1(3(7)8)2(6)4(9)10/h2*12-14,18H,5-11H2,1-4H3,(H,27,28)(H,24,25,26);1-2,5-6H,(H,7,8)(H,9,10)/t;;1-,2-/m..1/s1

HIDE SMILES / InChI

Molecular Formula	C4H6O6
Molecular Weight	150.0868
Charge	0
Count

Stereochemistry	ABSOLUTE
Additional Stereochemistry	No
Defined Stereocenters	2 / 2
E/Z Centers	0
Optical Activity	UNSPECIFIED

Molecular Formula	C23H32N6
Molecular Weight	392.5404
Charge	0
Count

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

Approval Year

Substance Class	Chemical Created by `admin` on `Sat Dec 16 08:53:44 UTC 2023` Edited by `admin` on `Sat Dec 16 08:53:44 UTC 2023`
Record UNII	HSV17TLD9C
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

TOREFORANT TARTRATE

Official Name

English

2-PYRIMIDINAMINE, 5-(5,7-DIMETHYL-1H-BENZIMIDAZOL-2-YL)-4-METHYL-N-(3-(1-METHYL-4-PIPERIDINYL)PROPYL)-, (2R,3R)-2,3-DIHYDROXYBUTANEDIOATE (2:1)

Systematic Name

English

Toreforant tartrate [WHO-DD]

Common Name

English

TOREFORANT TARTRATE [USAN]

Common Name

English

JNJ-38518168 HEMITARTRATE

Code

English

Classification Tree Code System Code

NCI_THESAURUS

C29708