2-PHENYL-4-(2-PROPEN-1-YLTHIO)-PYRIMIDINE

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NCATS

Details

Stereochemistry	ACHIRAL
Molecular Formula	C13H12N2S
Molecular Weight	228.313
Optical Activity	NONE
Defined Stereocenters	0 / 0
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of 2-PHENYL-4-(2-PROPEN-1-YLTHIO)-PYRIMIDINE

Structure Search

SMILES

C=CCSC1=NC(=NC=C1)C2=CC=CC=C2

InChI

InChIKey=PWWLXLYEUHJYMB-UHFFFAOYSA-N

InChI=1S/C13H12N2S/c1-2-10-16-12-8-9-14-13(15-12)11-6-4-3-5-7-11/h2-9H,1,10H2

HIDE SMILES / InChI

Molecular Formula	C13H12N2S
Molecular Weight	228.313
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 `Tue Apr 01 20:05:33 GMT 2025` Edited by `admin` on `Tue Apr 01 20:05:33 GMT 2025`
Record UNII	9X3IG790UH
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

2-PHENYL-4-(2-PROPEN-1-YLTHIO)-PYRIMIDINE

Systematic Name

English

NSC-88812

Preferred Name

English

PYRIMIDINE, 4-(ALLYLTHIO)-2-PHENYL-

Systematic Name

English

Code System Code Type Description

EPA CompTox

DTXSID80211091

Created by admin on Tue Apr 01 20:05:33 GMT 2025 , Edited by admin on Tue Apr 01 20:05:33 GMT 2025

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FDA UNII

9X3IG790UH

Created by admin on Tue Apr 01 20:05:33 GMT 2025 , Edited by admin on Tue Apr 01 20:05:33 GMT 2025

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NSC

88812

Created by admin on Tue Apr 01 20:05:33 GMT 2025 , Edited by admin on Tue Apr 01 20:05:33 GMT 2025

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CAS

6203-95-8

Created by admin on Tue Apr 01 20:05:33 GMT 2025 , Edited by admin on Tue Apr 01 20:05:33 GMT 2025

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PUBCHEM

96753

Created by admin on Tue Apr 01 20:05:33 GMT 2025 , Edited by admin on Tue Apr 01 20:05:33 GMT 2025

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