SHETA-2

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NCATS

Details

Stereochemistry	ACHIRAL
Molecular Formula	C20H23N3O2S2
Molecular Weight	401.546
Optical Activity	NONE
Defined Stereocenters	0 / 0
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of SHETA-2

Structure Search

SMILES

CC1(C)CC(C)(C)C2=CC(NC(=S)NC3=CC=C(C=C3)[N+]([O-])=O)=CC=C2S1

InChI

InChIKey=FWWKIYPMUZVMQG-UHFFFAOYSA-N

InChI=1S/C20H23N3O2S2/c1-19(2)12-20(3,4)27-17-10-7-14(11-16(17)19)22-18(26)21-13-5-8-15(9-6-13)23(24)25/h5-11H,12H2,1-4H3,(H2,21,22,26)

HIDE SMILES / InChI

Molecular Formula	C20H23N3O2S2
Molecular Weight	401.546
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 11:10:06 GMT 2025` Edited by `admin` on `Wed Apr 02 11:10:06 GMT 2025`
Record UNII	S886C92NJ7
Record Status	`Validated (UNII)`
Record Version

Download

Name

Type

Language

SHETA-2

Code

English

NSC-721689

Preferred Name

English

THIOUREA, N-(3,4-DIHYDRO-2,2,4,4-TETRAMETHYL-2H-1-BENZOTHIOPYRAN-6-YL)-N'-(4-NITROPHENYL)-

Systematic Name

English

SHetA2 [WHO-DD]

Common Name

English

N-(3,4-DIHYDRO-2,2,4,4-TETRAMETHYL-2H-1-BENZOTHIOPYRAN-6-YL)-N'-(4-NITROPHENYL)THIOUREA

Systematic Name

English

SHETA2

Code

English

NSC-726189

Code

English

Code System Code Type Description

NSC

726189

Created by admin on Wed Apr 02 11:10:06 GMT 2025 , Edited by admin on Wed Apr 02 11:10:06 GMT 2025

PRIMARY

CAS

361483-66-1

Created by admin on Wed Apr 02 11:10:06 GMT 2025 , Edited by admin on Wed Apr 02 11:10:06 GMT 2025

PRIMARY

NCI_THESAURUS

C181026

Created by admin on Wed Apr 02 11:10:06 GMT 2025 , Edited by admin on Wed Apr 02 11:10:06 GMT 2025

PRIMARY

NSC

721689

Created by admin on Wed Apr 02 11:10:06 GMT 2025 , Edited by admin on Wed Apr 02 11:10:06 GMT 2025

PRIMARY

FDA UNII

S886C92NJ7

Created by admin on Wed Apr 02 11:10:06 GMT 2025 , Edited by admin on Wed Apr 02 11:10:06 GMT 2025

PRIMARY

PUBCHEM

9844020

Created by admin on Wed Apr 02 11:10:06 GMT 2025 , Edited by admin on Wed Apr 02 11:10:06 GMT 2025

PRIMARY

Related Record Type Details


					S886C92NJ7

SHETA-2

ACTIVE MOIETY

Amount: