Vitas-M small molecule compound

1-(3,5-dimethoxyphenyl)-3-(4H-1,2,4-triazol-3-ylsulfanyl)pyrrolidine-2,5-dione

Catalog ID
STK022719
SMILES COc1cc(OC)cc(c1)N1C(=O)CC(C1=O)Sc1[nH]cnn1

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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 C14H14N4O4S MW 334.36 g/mol Purity >90% as per NMR
InChI
InChI=1S/C14H14N4O4S/c1-21-9-3-8(4-10(5-9)22-2)18-12(19)6-11(13(18)20)23-14-15-7-16-17-14/h3-5,7,11H,6H2,1-2H3,(H,15,16,17)
InChIKey
NYZXCJNMENRVTR-UHFFFAOYSA-N
Synonyms
384349-11-5
(3R)1(35DIMETHOXYPHENYL)3(1H124TRIAZOL5YLSULFANYL)PYRROLIDINE25DIONE
1(35DIMETHOXYPHENYL)3(1H124TRIAZOL5YLSULFANYL)PYRROLIDINE25DIONE
1(35DIMETHOXYPHENYL)3(4H124TRIAZOL3YLSULFANYL)PYRROLIDINE25DIONE
1(35DIMETHOXYPHENYL)3(4H124TRIAZOL3YLTHIO)PYRROLIDINE25DIONE
3((4H124triazol3yl)thio)1(35dimethoxyphenyl)pyrrolidine25dione
384349115
COC1=CC(=CC(=C1)N2C(=O)CC(C2=O)SC3=NC=NN3)OC
COc1cc(OC)cc(c1)N1C(=O)CC(C1=O)Sc1(nH)cnn1
InChI=1SC14H14N4O4Sc121938(410(59)222)1812(19)611(13(18)20)2314157161714h35711H6H212H3(H151617)
MFCD03146271
STK022719
ZINC000002730543
ZINC000018283722

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Available files

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