Vitas-M small molecule compound

5-acetyl-4-(2-hydroxy-3-nitrophenyl)-6-methyl-3,4-dihydropyrimidin-2(1H)-one

Catalog ID
STL174239
SMILES O=C1NC(=C(C(N1)c1cccc(c1O)[N+](=O)[O-])C(=O)C)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 C13H13N3O5 MW 291.26 g/mol Purity >90% as per NMR
InChI
InChI=1S/C13H13N3O5/c1-6-10(7(2)17)11(15-13(19)14-6)8-4-3-5-9(12(8)18)16(20)21/h3-5,11,18H,1-2H3,(H2,14,15,19)
InChIKey
GRLYCEBEOKFKCX-UHFFFAOYSA-N
Synonyms
444925-48-8
444925488
5ACETYL4(2HYDROXY3NITROPHENYL)6METHYL34DIHYDRO1HPYRIMIDIN2ONE
5ACETYL4(2HYDROXY3NITROPHENYL)6METHYL34DIHYDRO2(1H)PYRIMIDINONE
5acetyl4(2hydroxy3nitrophenyl)6methyl34dihydropyrimidin2(1H)one
CC1=C(C(NC(=O)N1)C2=C(C(=CC=C2)(N+)(=O)(O))O)C(=O)C
InChI=1SC13H13N3O5c1610(7(2)17)11(1513(19)146)84359(12(8)18)16(20)21h351118H12H3(H2141519)
MFCD02606239
O=C1NC(=C(C(N1)c1cccc(c1O)(N+)(=O)(O))C(=O)C)C
ZINC000020234864
ZINC000020234868

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Available files

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