Vitas-M small molecule compound

methyl 3-{[2-(morpholin-4-yl)-3,4-dioxocyclobut-1-en-1-yl]amino}thiophene-2-carboxylate

Catalog ID
STL407722
SMILES COC(=O)c1sccc1NC1=C(C(=O)C1=O)N1CCOCC1

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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 C14H14N2O5S MW 322.34 g/mol Purity >90% as per NMR
InChI
InChI=1S/C14H14N2O5S/c1-20-14(19)13-8(2-7-22-13)15-9-10(12(18)11(9)17)16-3-5-21-6-4-16/h2,7,15H,3-6H2,1H3
InChIKey
YSMKCYYISUYUAU-UHFFFAOYSA-N
Synonyms
1630836-01-9
1630836019
COC(=O)C1=C(C=CS1)NC2=C(C(=O)C2=O)N3CCOCC3
InChI=1SC14H14N2O5Sc12014(19)138(272213)15910(12(18)11(9)17)1635216416h2715H36H21H3
methyl3((2(morpholin4yl)34dioxocyclobut1en1yl)amino)thiophene2carboxylate
methyl3((2morpholin4yl34dioxocyclobuten1yl)amino)thiophene2carboxylate
methyl3((2morpholino34dioxocyclobut1en1yl)amino)thiophene2carboxylate
MFCD28368414
ZINC000218419450
ZINC218419450

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Available files

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