2-ACETYL-1-AMINO-4-((4-((1-METHYLETHYL)AMINO)-6-PHENYL-1,3,5-TRIAZIN-2-YL)AMINO)-9,10-ANTHRACENEDIONE

Details

Stereochemistry	ACHIRAL
Molecular Formula	C28H24N6O3
Molecular Weight	492.5286
Optical Activity	NONE
Defined Stereocenters	0 / 0
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of 2-ACETYL-1-AMINO-4-((4-((1-METHYLETHYL)AMINO)-6-PHENYL-1,3,5-TRIAZIN-2-YL)AMINO)-9,10-ANTHRACENEDIONE

Structure Search

SMILES

CC(C)NC1=NC(NC2=C3C(=O)C4=CC=CC=C4C(=O)C3=C(N)C(=C2)C(C)=O)=NC(=N1)C5=CC=CC=C5

InChI

InChIKey=ZNPYBNNSPKOGPQ-UHFFFAOYSA-N

InChI=1S/C28H24N6O3/c1-14(2)30-27-32-26(16-9-5-4-6-10-16)33-28(34-27)31-20-13-19(15(3)35)23(29)22-21(20)24(36)17-11-7-8-12-18(17)25(22)37/h4-14H,29H2,1-3H3,(H2,30,31,32,33,34)

HIDE SMILES / InChI

Molecular Formula	C28H24N6O3
Molecular Weight	492.5286
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 12:01:41 GMT 2023` Edited by `admin` on `Sat Dec 16 12:01:41 GMT 2023`
Record UNII	KCW8F7LE1M
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

2-ACETYL-1-AMINO-4-((4-((1-METHYLETHYL)AMINO)-6-PHENYL-1,3,5-TRIAZIN-2-YL)AMINO)-9,10-ANTHRACENEDIONE

Systematic Name

English

9,10-ANTHRACENEDIONE, 2-ACETYL-1-AMINO-4-((4-((1-METHYLETHYL)AMINO)-6-PHENYL-1,3,5-TRIAZIN-2-YL)AMINO)-

Systematic Name

English

Code System Code Type Description

EPA CompTox

DTXSID8070047