Vitas-M small molecule compound

5-(3-bromophenyl)-3-hydroxy-1-(pyridin-3-ylmethyl)-4-(thiophen-2-ylcarbonyl)-1,5-dihydro-2H-pyrrol-2-one

Catalog ID
STK896931
SMILES Brc1cccc(c1)C1N(Cc2cccnc2)C(=O)C(=C1C(=O)c1cccs1)O

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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 C21H15BrN2O3S MW 455.33 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H15BrN2O3S/c22-15-6-1-5-14(10-15)18-17(19(25)16-7-3-9-28-16)20(26)21(27)24(18)12-13-4-2-8-23-11-13/h1-11,18,26H,12H2
InChIKey
GTKFTXFOBRJRER-UHFFFAOYSA-N
Synonyms
380866-42-2
(5R)5(3BROMOPHENYL)3HYDROXY1(PYRIDIN3YLMETHYL)4(THIOPHEN2YLCARBONYL)15DIHYDRO2HPYRROL2ONE
(5S)5(3BROMOPHENYL)3HYDROXY1(PYRIDIN3YLMETHYL)4(THIOPHEN2YLCARBONYL)15DIHYDRO2HPYRROL2ONE
2(3BROMOPHENYL)4HYDROXY1(PYRIDIN3YLMETHYL)3(THIOPHENE2CARBONYL)2HPYRROL5ONE
2(3BROMOPHENYL)5OXO1(PYRIDIN1IUM3YLMETHYL)3(THIOPHENE2CARBONYL)2HPYRROL4OLATE
380866422
5(3bromophenyl)3hydroxy1(pyridin3ylmethyl)4(thiophen2ylcarbonyl)15dihydro2Hpyrrol2one
5(3BROMOPHENYL)3HYDROXY1(PYRIDIN3YLMETHYL)4(THIOPHENE2CARBONYL)1HPYRROL2(5H)ONE
C1=CC(=CC(=C1)Br)C2C(=C(C(=O)N2CC3=C(NH+)=CC=C3)(O))C(=O)C4=CC=CS4
InChI=1SC21H15BrN2O3Sc221561514(1015)1817(19(25)167392816)20(26)21(27)24(18)1213428231113h1111826H12H2
MFCD02991089
ZINC000009046254
ZINC000009123751

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Available files

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