AGOMELATINE UREA

Details

Stereochemistry	ACHIRAL
Molecular Formula	C15H17NO2.CH4N2O
Molecular Weight	303.3562
Optical Activity	NONE
Defined Stereocenters	0 / 0
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure Search

SMILES

NC(N)=O.COC1=CC2=C(CCNC(C)=O)C=CC=C2C=C1

InChI

InChIKey=BPUPSZLQAHZJGV-UHFFFAOYSA-N

InChI=1S/C15H17NO2.CH4N2O/c1-11(17)16-9-8-13-5-3-4-12-6-7-14(18-2)10-15(12)13;2-1(3)4/h3-7,10H,8-9H2,1-2H3,(H,16,17);(H4,2,3,4)

HIDE SMILES / InChI

Molecular Formula	C15H17NO2
Molecular Weight	243.301
Charge	0
Count

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

Molecular Formula	CH4N2O
Molecular Weight	60.0553
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 16:08:53 UTC 2023` Edited by `admin` on `Sat Dec 16 16:08:53 UTC 2023`
Record UNII	R0YYF5RUG8
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

AGOMELATINE UREA

Common Name

English

UREA, COMPD. WITH N-(2-(7-METHOXY-1-NAPHTHALENYL)ETHYL)ACETAMIDE (1:1)

Systematic Name

English

Agomelatine urea [WHO-DD]

Common Name

English

Code System Code Type Description

CAS

1366181-82-9

Created by admin on Sat Dec 16 16:08:53 UTC 2023 , Edited by admin on Sat Dec 16 16:08:53 UTC 2023

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PUBCHEM

71496303

Created by admin on Sat Dec 16 16:08:53 UTC 2023 , Edited by admin on Sat Dec 16 16:08:53 UTC 2023

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FDA UNII

R0YYF5RUG8

Created by admin on Sat Dec 16 16:08:53 UTC 2023 , Edited by admin on Sat Dec 16 16:08:53 UTC 2023

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SMS_ID

100000171891

Created by admin on Sat Dec 16 16:08:53 UTC 2023 , Edited by admin on Sat Dec 16 16:08:53 UTC 2023

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