TYRPHOSTIN 47

Details

Stereochemistry	ACHIRAL
Molecular Formula	C10H8N2O2S
Molecular Weight	220.248
Optical Activity	NONE
Defined Stereocenters	0 / 0
E/Z Centers	1
Charge	0

SHOW SMILES / InChI

Structure Search

SMILES

NC(=S)C(=C\C1=CC=C(O)C(O)=C1)\C#N

InChI

InChIKey=ZGHQGWOETPXKLY-XVNBXDOJSA-N

InChI=1S/C10H8N2O2S/c11-5-7(10(12)15)3-6-1-2-8(13)9(14)4-6/h1-4,13-14H,(H2,12,15)/b7-3+

HIDE SMILES / InChI

Molecular Formula	C10H8N2O2S
Molecular Weight	220.248
Charge	0
Count

Stereochemistry	ACHIRAL
Additional Stereochemistry	No
Defined Stereocenters	0 / 0
E/Z Centers	1
Optical Activity	NONE

Approval Year

Targets

Primary Target	Pharmacology	Condition	Potency
Epidermal growth factor receptor erbB1 62 Target ID: CHEMBL203 Sources: https://www.ncbi.nlm.nih.gov/pubmed/18321716 \| https://www.ncbi.nlm.nih.gov/pubmed/2552117	Inhibitor 8504		2.4 µM [IC50]
Herpes simplex virus (type 1 / strain F) 3 Target ID: CHEMBL613200 Sources: https://www.ncbi.nlm.nih.gov/pubmed/7544112	Inhibitor 8504

Substance Class	Chemical Created by `admin` on `Mon Mar 31 19:52:23 GMT 2025` Edited by `admin` on `Mon Mar 31 19:52:23 GMT 2025`
Record UNII	HKQ7UDF4J7
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

TYRPHOSTIN 47

Common Name

English

AG-213

Preferred Name

English

2-Propenethioamide, 2-cyano-3-(3,4-dihydroxyphenyl)-

Systematic Name

English

(2E)-2-Cyano-3-(3,4-dihydroxyphenyl)-2-propenethioamide

Systematic Name

English

2-Cyano-3-(3,4-dihydroxyphenyl)-2-propenethioamide

Common Name

English

RG-50864

Code

English

2-Propenethioamide, 2-cyano-3-(3,4-dihydroxyphenyl)-, (2E)-

Systematic Name

English

3,4-Dihydroxy-?-cyanothiocinnamamide

Common Name

English

NSC-638083

Code

English

2-Propenethioamide, 2-cyano-3-(3,4-dihydroxyphenyl)-, (E)-

Systematic Name

English

Code System Code Type Description

EPA CompTox

DTXSID701018041