Vitas-M small molecule compound

cyclopentyl 6-methyl-2-oxo-4-phenyl-1,2,3,4-tetrahydropyrimidine-5-carboxylate

Catalog ID
STK062403
SMILES O=C1NC(=C(C(N1)c1ccccc1)C(=O)OC1CCCC1)C

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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 C17H20N2O3 MW 300.36 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H20N2O3/c1-11-14(16(20)22-13-9-5-6-10-13)15(19-17(21)18-11)12-7-3-2-4-8-12/h2-4,7-8,13,15H,5-6,9-10H2,1H3,(H2,18,19,21)
InChIKey
NIRYAFJACFZZFX-UHFFFAOYSA-N
Synonyms

CC1=C(C(NC(=O)N1)C2=CC=CC=C2)C(=O)OC3CCCC3
CYCLOPENTYL4METHYL2OXO6PHENYL136TRIHYDROPYRIMIDINE5CARBOXYLATE
cyclopentyl6methyl2oxo4phenyl1234tetrahydropyrimidine5carboxylate
CYCLOPENTYL6METHYL2OXO4PHENYL34DIHYDRO1HPYRIMIDINE5CARBOXYLATE
InChI=1SC17H20N2O3c11114(16(20)22139561013)15(1917(21)1811)127324812h24781315H56910H21H3(H2181921)
MFCD00401682
O=C1NC(=C(C(N1)c1ccccc1)C(=O)OC1CCCC1)C
STK062403
ZINC000000194777
ZINC000000194778

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Available files

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