Methyl 2,3-dihydro-3-phenyl-2-thioxo-1H-imidazole-4-carboxylate

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Details

Stereochemistry	ACHIRAL
Molecular Formula	C11H10N2O2S
Molecular Weight	234.274
Optical Activity	NONE
Defined Stereocenters	0 / 0
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of Methyl 2,3-dihydro-3-phenyl-2-thioxo-1H-imidazole-4-carboxylate

Structure Search

SMILES

COC(=O)C1=CNC(=S)N1C2=CC=CC=C2

InChI

InChIKey=LBAHSLRQMFWHLF-UHFFFAOYSA-N

InChI=1S/C11H10N2O2S/c1-15-10(14)9-7-12-11(16)13(9)8-5-3-2-4-6-8/h2-7H,1H3,(H,12,16)

HIDE SMILES / InChI

Molecular Formula	C11H10N2O2S
Molecular Weight	234.274
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 20:24:19 GMT 2025` Edited by `admin` on `Tue Apr 01 20:24:19 GMT 2025`
Record UNII	45Z7GJQ7T4
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

NSC-97021

Preferred Name

English

Methyl 2,3-dihydro-3-phenyl-2-thioxo-1H-imidazole-4-carboxylate

Systematic Name

English

Methyl 3-phenyl-2-sulfanylidene-1H-imidazole-4-carboxylate

Systematic Name

English

1H-Imidazole-4-carboxylic acid, 2,3-dihydro-3-phenyl-2-thioxo-, methyl ester

Systematic Name

English

Code System Code Type Description

EPA CompTox

DTXSID20232604

Created by admin on Tue Apr 01 20:24:19 GMT 2025 , Edited by admin on Tue Apr 01 20:24:19 GMT 2025

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FDA UNII

45Z7GJQ7T4

Created by admin on Tue Apr 01 20:24:19 GMT 2025 , Edited by admin on Tue Apr 01 20:24:19 GMT 2025

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ECHA (EC/EINECS)

280-693-6

Created by admin on Tue Apr 01 20:24:19 GMT 2025 , Edited by admin on Tue Apr 01 20:24:19 GMT 2025

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NSC

97021

Created by admin on Tue Apr 01 20:24:19 GMT 2025 , Edited by admin on Tue Apr 01 20:24:19 GMT 2025

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CAS

83763-09-1

Created by admin on Tue Apr 01 20:24:19 GMT 2025 , Edited by admin on Tue Apr 01 20:24:19 GMT 2025

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PUBCHEM

3034542

Created by admin on Tue Apr 01 20:24:19 GMT 2025 , Edited by admin on Tue Apr 01 20:24:19 GMT 2025

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