Vitas-M small molecule compound

ethyl 1-ethyl-6-{[4-(3-methylbenzyl)piperazin-1-yl]methyl}-2-oxo-4-phenyl-1,2,3,4-tetrahydropyrimidine-5-carboxylate

Catalog ID
STL178559
SMILES CCOC(=O)C1=C(CN2CCN(CC2)Cc2cccc(c2)C)N(CC)C(=O)NC1c1ccccc1

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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 C28H36N4O3 MW 476.62 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H36N4O3/c1-4-32-24(20-31-16-14-30(15-17-31)19-22-11-9-10-21(3)18-22)25(27(33)35-5-2)26(29-28(32)34)23-12-7-6-8-13-23/h6-13,18,26H,4-5,14-17,19-20H2,1-3H3,(H,29,34)
InChIKey
IRZQEQYSNNHSTN-UHFFFAOYSA-N
Synonyms

CCN1C(=C(C(NC1=O)C2=CC=CC=C2)C(=O)OCC)CN3CCN(CC3)CC4=CC=CC(=C4)C
ethyl1ethyl6((4(3methylbenzyl)piperazin1yl)methyl)2oxo4phenyl1234tetrahydropyrimidine5carboxylate
ethyl3ethyl4((4((3methylphenyl)methyl)piperazin1yl)methyl)2oxo6phenyl16dihydropyrimidine5carboxylate
InChI=1SC28H36N4O3c143224(2031161430(151731)19221191021(3)1822)25(27(33)3552)26(2928(32)34)23127681323h6131826H4514171920H213H3(H2934)
MFCD05667427
ZINC000028631979
ZINC000028631981

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Available files

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