Vitas-M small molecule compound

5-acetyl-4-{4-[(2-chlorobenzyl)oxy]-3-ethoxyphenyl}-6-phenyl-3,4-dihydropyrimidin-2(1H)-one

Catalog ID
STL181532
SMILES CCOc1cc(ccc1OCc1ccccc1Cl)C1NC(=O)NC(=C1C(=O)C)c1ccccc1

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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 C27H25ClN2O4 MW 476.96 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H25ClN2O4/c1-3-33-23-15-19(13-14-22(23)34-16-20-11-7-8-12-21(20)28)26-24(17(2)31)25(29-27(32)30-26)18-9-5-4-6-10-18/h4-15,26H,3,16H2,1-2H3,(H2,29,30,32)
InChIKey
DLDFSKHIKQKQHZ-UHFFFAOYSA-N
Synonyms

(4R)5ACETYL4(4((2CHLOROBENZYL)OXY)3ETHOXYPHENYL)6PHENYL34DIHYDROPYRIMIDIN2(1H)ONE
5acetyl4(4((2chlorobenzyl)oxy)3ethoxyphenyl)6phenyl34dihydropyrimidin2(1H)one
5ACETYL4(4((2CHLOROPHENYL)METHOXY)3ETHOXYPHENYL)6PHENYL34DIHYDRO1HPYRIMIDIN2ONE
CCOC1=C(C=CC(=C1)C2C(=C(NC(=O)N2)C3=CC=CC=C3)C(=O)C)OCC4=CC=CC=C4Cl
InChI=1SC27H25ClN2O4c1333231519(131422(23)34162011781221(20)28)2624(17(2)31)25(2927(32)3026)1895461018h41526H316H212H3(H2293032)
MFCD05993206
ZINC000002773805
ZINC000002773806

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Available files

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