ALMOTRIPTAN DIMER

Details

Stereochemistry	ACHIRAL
Molecular Formula	C30H41N5O2S
Molecular Weight	535.744
Optical Activity	NONE
Defined Stereocenters	0 / 0
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure Search

SMILES

CN(C)CCC1=CNC2=CC=C(CC3=C(CCN(C)C)C4=CC(CS(=O)(=O)N5CCCC5)=CC=C4N3)C=C12

InChI

InChIKey=VDRAYCJVAGIHOY-UHFFFAOYSA-N

InChI=1S/C30H41N5O2S/c1-33(2)15-11-24-20-31-28-9-7-22(17-26(24)28)19-30-25(12-16-34(3)4)27-18-23(8-10-29(27)32-30)21-38(36,37)35-13-5-6-14-35/h7-10,17-18,20,31-32H,5-6,11-16,19,21H2,1-4H3

HIDE SMILES / InChI

Molecular Formula	C30H41N5O2S
Molecular Weight	535.744
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 10:48:57 UTC 2023` Edited by `admin` on `Sat Dec 16 10:48:57 UTC 2023`
Record UNII	U9US7T5ZRK
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

ALMOTRIPTAN DIMER

Common Name

English

2-(2-((3-(2-(DIMETHYLAMINO)ETHYL)-1H-INDOL-5-YL)METHYL)-5-((PYRROLIDINE-1-SULFONYL)METHYL)-1H-INDOL-3-YL)-N,N-DIMETHYLETHAN-1-AMINE

Systematic Name

English

ALMOTRIPTAN MALATE IMPURITY B [EP IMPURITY]

Common Name

English

1H-INDOLE-3-ETHANAMINE, 2-((3-(2-(DIMETHYLAMINO)ETHYL)-1H-INDOL-5-YL)METHYL)-N,N-DIMETHYL-5-((1-PYRROLIDINYLSULFONYL)METHYL)-

Systematic Name

English

2-((3-(2-(DIMETHYLAMINO)ETHYL)-1H-INDOL-5-YL)METHYL)-N,N-DIMETHYL-5-((1-PYRROLIDINYLSULFONYL)METHYL)-1H-INDOLE-3-ETHANAMINE

Systematic Name

English

Code System Code Type Description

CAS

1330166-13-6

Created by admin on Sat Dec 16 10:48:57 UTC 2023 , Edited by admin on Sat Dec 16 10:48:57 UTC 2023

PRIMARY

PUBCHEM

71313109

Created by admin on Sat Dec 16 10:48:57 UTC 2023 , Edited by admin on Sat Dec 16 10:48:57 UTC 2023

PRIMARY

EPA CompTox

DTXSID00746976

Created by admin on Sat Dec 16 10:48:57 UTC 2023 , Edited by admin on Sat Dec 16 10:48:57 UTC 2023

PRIMARY

FDA UNII

U9US7T5ZRK

Created by admin on Sat Dec 16 10:48:57 UTC 2023 , Edited by admin on Sat Dec 16 10:48:57 UTC 2023

PRIMARY

Related Record Type Details


					PJP312605E

ALMOTRIPTAN MALATE

PARENT -> IMPURITY

Interaction Type:

CHROMATOGRAPHIC PURITY (HPLC/UV)

Qualification:

EP

Amount: