Vitas-M small molecule compound

methyl 6-[(4-carbamoylpiperidin-1-yl)methyl]-2-oxo-4-(thiophen-2-yl)-1,2,3,4-tetrahydropyrimidine-5-carboxylate

Catalog ID
STL028044
SMILES COC(=O)C1=C(CN2CCC(CC2)C(=O)N)NC(=O)NC1c1cccs1

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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 C17H22N4O4S MW 378.45 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H22N4O4S/c1-25-16(23)13-11(9-21-6-4-10(5-7-21)15(18)22)19-17(24)20-14(13)12-3-2-8-26-12/h2-3,8,10,14H,4-7,9H2,1H3,(H2,18,22)(H2,19,20,24)
InChIKey
KJNOPDJXOBPNSG-UHFFFAOYSA-N
Synonyms

COC(=O)C1=C(NC(=O)NC1C2=CC=CS2)CN3CCC(CC3)C(=O)N
InChI=1SC17H22N4O4Sc12516(23)1311(9216410(5721)15(18)22)1917(24)2014(13)123282612h2381014H479H21H3(H21822)(H2192024)
methyl6((4carbamoylpiperidin1yl)methyl)2oxo4(thiophen2yl)1234tetrahydropyrimidine5carboxylate
methyl6((4carbamoylpiperidin1yl)methyl)2oxo4thiophen2yl34dihydro1Hpyrimidine5carboxylate
MFCD18188635
ZINC000057415902
ZINC000057415904

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Available files

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