ISCOTRIZINOL BENZAMIDE TRIESTER

Details

Stereochemistry	MIXED
Molecular Formula	C55H71N7O7
Molecular Weight	942.1949
Optical Activity	UNSPECIFIED
Defined Stereocenters	0 / 3
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of ISCOTRIZINOL BENZAMIDE TRIESTER

Structure Search

SMILES

CCCCC(CC)COC(=O)C1=CC=C(NC(=O)C2=CC=C(NC3=NC(NC4=CC=C(C=C4)C(=O)OCC(CC)CCCC)=NC(NC5=CC=C(C=C5)C(=O)OCC(CC)CCCC)=N3)C=C2)C=C1

InChI

InChIKey=VSMRWUYOQNPDLS-UHFFFAOYSA-N

InChI=1S/C55H71N7O7/c1-7-13-16-38(10-4)35-67-50(64)42-21-29-45(30-22-42)56-49(63)41-19-27-46(28-20-41)57-53-60-54(58-47-31-23-43(24-32-47)51(65)68-36-39(11-5)17-14-8-2)62-55(61-53)59-48-33-25-44(26-34-48)52(66)69-37-40(12-6)18-15-9-3/h19-34,38-40H,7-18,35-37H2,1-6H3,(H,56,63)(H3,57,58,59,60,61,62)

HIDE SMILES / InChI

Molecular Formula	C55H71N7O7
Molecular Weight	942.1949
Charge	0
Count

Stereochemistry	MIXED
Additional Stereochemistry	No
Defined Stereocenters	0 / 3
E/Z Centers	0
Optical Activity	UNSPECIFIED

Approval Year

Substance Class	Chemical Created by `admin` on `Wed Apr 02 11:35:03 GMT 2025` Edited by `admin` on `Wed Apr 02 11:35:03 GMT 2025`
Record UNII	942KXB7ZER
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

ISCOTRIZINOL BENZAMIDE TRIESTER

Common Name

English

ISCOTRIZINOL BENZAMIDE TRIESTER ANALOG [USP IMPURITY]

Preferred Name

English

ISCOTRIZINOL RELATED COMPOUND I [USP IMPURITY]

Common Name

English

ISCOTRIZINOL RELATED COMPOUND I [USP-RS]

Common Name

English

BIS(2-ETHYLHEXYL) 4,4'-((6-((4-((4-(((2-ETHYLHEXYL)OXY)CARBONYL)PHENYL)CARBAMOYL)PHENYL)AMINO)-1,3,5-TRIAZINE-2,4-DIYL)BIS(AZANEDIYL))DIBENZOATE

Systematic Name

English

Code System Code Type Description

CAS

2174063-30-8

Created by admin on Wed Apr 02 11:35:03 GMT 2025 , Edited by admin on Wed Apr 02 11:35:03 GMT 2025

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PUBCHEM

134214855

Created by admin on Wed Apr 02 11:35:03 GMT 2025 , Edited by admin on Wed Apr 02 11:35:03 GMT 2025

PRIMARY

FDA UNII

942KXB7ZER

Created by admin on Wed Apr 02 11:35:03 GMT 2025 , Edited by admin on Wed Apr 02 11:35:03 GMT 2025

PRIMARY

RS_ITEM_NUM

1193447

Created by admin on Wed Apr 02 11:35:03 GMT 2025 , Edited by admin on Wed Apr 02 11:35:03 GMT 2025

PRIMARY

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ISCOTRIZINOL

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