1,4,5-TRIS((4-(1,1-DIMETHYLETHYL)PHENYL)THIO)-8-(PHENYLTHIO)ANTHRAQUINONE

Details

Stereochemistry	ACHIRAL
Molecular Formula	C50H48O2S4
Molecular Weight	809.175
Optical Activity	NONE
Defined Stereocenters	0 / 0
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of 1,4,5-TRIS((4-(1,1-DIMETHYLETHYL)PHENYL)THIO)-8-(PHENYLTHIO)ANTHRAQUINONE

Structure Search

SMILES

CC(C)(C)C1=CC=C(SC2=CC=C(SC3=CC=CC=C3)C4=C2C(=O)C5=C(SC6=CC=C(C=C6)C(C)(C)C)C=CC(SC7=CC=C(C=C7)C(C)(C)C)=C5C4=O)C=C1

InChI

InChIKey=HGBWYYMBPQTZNS-UHFFFAOYSA-N

InChI=1S/C50H48O2S4/c1-48(2,3)31-15-21-35(22-16-31)54-39-28-27-38(53-34-13-11-10-12-14-34)42-43(39)47(52)45-41(56-37-25-19-33(20-26-37)50(7,8)9)30-29-40(44(45)46(42)51)55-36-23-17-32(18-24-36)49(4,5)6/h10-30H,1-9H3

HIDE SMILES / InChI

Molecular Formula	C50H48O2S4
Molecular Weight	809.175
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 `Wed Apr 02 09:22:14 GMT 2025` Edited by `admin` on `Wed Apr 02 09:22:14 GMT 2025`
Record UNII	XQX9ABC7RO
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

9,10-ANTHRACENEDIONE, 1,4,5-TRIS((4-(1,1-DIMETHYLETHYL)PHENYL)THIO)-8-(PHENYLTHIO)-

Preferred Name

English

1,4,5-TRIS((4-(1,1-DIMETHYLETHYL)PHENYL)THIO)-8-(PHENYLTHIO)ANTHRAQUINONE

Common Name

English

Code System Code Type Description

CAS

84434-37-7