CI-1044

Details

Stereochemistry	ABSOLUTE
Molecular Formula	C23H19N5O2
Molecular Weight	397.4293
Optical Activity	UNSPECIFIED
Defined Stereocenters	1 / 1
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure Search

SMILES

NC1=CC2=C3N(CC2)C(=O)[C@H](NC(=O)C4=CN=CC=C4)N=C(C5=CC=CC=C5)C3=C1

InChI

InChIKey=XGXOSJSGDNPEEF-NRFANRHFSA-N

InChI=1S/C23H19N5O2/c24-17-11-15-8-10-28-20(15)18(12-17)19(14-5-2-1-3-6-14)26-21(23(28)30)27-22(29)16-7-4-9-25-13-16/h1-7,9,11-13,21H,8,10,24H2,(H,27,29)/t21-/m0/s1

HIDE SMILES / InChI

Molecular Formula	C23H19N5O2
Molecular Weight	397.4293
Charge	0
Count

Stereochemistry	ABSOLUTE
Additional Stereochemistry	No
Defined Stereocenters	1 / 1
E/Z Centers	0
Optical Activity	UNSPECIFIED

Approval Year

Substance Class	Chemical Created by `admin` on `Fri Dec 15 15:29:45 GMT 2023` Edited by `admin` on `Fri Dec 15 15:29:45 GMT 2023`
Record UNII	O4T475XIIY
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

CI-1044

Common Name

English

3-PYRIDINECARBOXAMIDE, N-((3R)-9-AMINO-3,4,6,7-TETRAHYDRO-4-OXO-1-PHENYLPYRROLO(3,2,1-JK)(1,4)BENZODIAZEPIN-3-YL)-

Systematic Name

English

PD-189659

Code

English

(+)-CI-1044

Code

English

3-PYRIDINECARBOXAMIDE, N-(9-AMINO-3,4,6,7-TETRAHYDRO-4-OXO-1-PHENYLPYRROLO(3,2,1-JK)(1,4)BENZODIAZEPIN-3-YL)-, (R)-

Systematic Name

English

Code System Code Type Description

CAS

197894-84-1

Created by admin on Fri Dec 15 15:29:45 GMT 2023 , Edited by admin on Fri Dec 15 15:29:45 GMT 2023

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PUBCHEM

9843744

Created by admin on Fri Dec 15 15:29:45 GMT 2023 , Edited by admin on Fri Dec 15 15:29:45 GMT 2023

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FDA UNII

O4T475XIIY

Created by admin on Fri Dec 15 15:29:45 GMT 2023 , Edited by admin on Fri Dec 15 15:29:45 GMT 2023

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Related Record Type Details


					O4T475XIIY

CI-1044

ACTIVE MOIETY