TOP-1288

Investigational

Details

Stereochemistry	ACHIRAL
Molecular Formula	C43H49N7O9S
Molecular Weight	839.956
Optical Activity	NONE
Defined Stereocenters	0 / 0
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure Search

SMILES

COCCOCCOCCNC(=O)C1=CC(=CC(NC2=NC=CC(OC3=C4C=CC=CC4=C(NC(=O)NC5=CC(=CC(NS(C)(=O)=O)=C5OC)C(C)(C)C)C=C3)=N2)=C1)C#C

InChI

InChIKey=FWXVGKSWZJEPQI-UHFFFAOYSA-N

InChI=1S/C43H49N7O9S/c1-8-28-23-29(40(51)44-17-18-57-21-22-58-20-19-55-5)25-31(24-28)46-41-45-16-15-38(49-41)59-37-14-13-34(32-11-9-10-12-33(32)37)47-42(52)48-35-26-30(43(2,3)4)27-36(39(35)56-6)50-60(7,53)54/h1,9-16,23-27,50H,17-22H2,2-7H3,(H,44,51)(H,45,46,49)(H2,47,48,52)

HIDE SMILES / InChI

Molecular Formula	C43H49N7O9S
Molecular Weight	839.956
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 14:08:35 GMT 2023` Edited by `admin` on `Sat Dec 16 14:08:35 GMT 2023`
Record UNII	19ZTZ9YC4O
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

TOP-1288

Code

English

BENZAMIDE, 3-((4-((4-((((5-(1,1-DIMETHYLETHYL)-2-METHOXY-3-((METHYLSULFONYL)AMINO)PHENYL)AMINO)CARBONYL)AMINO)-1-NAPHTHALENYL)OXY)-2-PYRIMIDINYL)AMINO)-5-ETHYNYL-N-(2-(2-(2-METHOXYETHOXY)ETHOXY)ETHYL)-

Systematic Name

English

TOP1288

Code

English

Code System Code Type Description

CAS

1630202-02-6