Vitas-M small molecule compound

2-(2-ethylphenyl)-3-thioxohexahydro-1H-pyrrolo[1,2-c]imidazol-1-one

Catalog ID
STK306314
SMILES CCc1ccccc1N1C(=S)N2C(C1=O)CCC2

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We supply compounds in quantities from 1 mg up to 5 g for research and development purposes only.

We do not supply quantities above 5 g.

Structure and other identifiers

2D representation rendered from the SMILES, with core physicochemical data.
Formula C14H16N2OS MW 260.36 g/mol Purity >90% as per NMR
InChI
InChI=1S/C14H16N2OS/c1-2-10-6-3-4-7-11(10)16-13(17)12-8-5-9-15(12)14(16)18/h3-4,6-7,12H,2,5,8-9H2,1H3
InChIKey
RVXQKYWDPAPVEM-UHFFFAOYSA-N
Synonyms
1028055-91-5
1028055915
2(2ethylphenyl)3sulfanylidene5677atetrahydropyrrolo(12c)imidazol1one
2(2ethylphenyl)3thioxohexahydro1Hpyrrolo(12c)imidazol1one
CCC1=CC=CC=C1N2C(=O)C3CCCN3C2=S
InChI=1SC14H16N2OSc1210634711(10)1613(17)1285915(12)14(16)18h346712H2589H21H3
MFCD03451879
ZINC000000217523
ZINC000000217525

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.