Vitas-M small molecule compound

3-(5-methyl-2,7-dioxo-3-phenyl-1,2,4,7-tetrahydropyrazolo[1,5-a]pyrimidin-6-yl)propanoic acid

Catalog ID
STL373546
SMILES OC(=O)CCc1c(C)[nH]c2n(c1=O)[nH]c(=O)c2c1ccccc1

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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 C16H15N3O4 MW 313.31 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H15N3O4/c1-9-11(7-8-12(20)21)16(23)19-14(17-9)13(15(22)18-19)10-5-3-2-4-6-10/h2-6,17H,7-8H2,1H3,(H,18,22)(H,20,21)
InChIKey
SWEKWCAWVCDZND-UHFFFAOYSA-N
Synonyms
1245569-14-5
1245569145
3(5methyl27dioxo3phenyl1247tetrahydropyrazolo(15a)pyrimidin6yl)propanoicacid
3(5methyl27dioxo3phenyl14dihydropyrazolo(15a)pyrimidin6yl)propanoicacid
3(5METHYL27DIOXO3PHENYL48DIHYDRO3PYRAZOLINO(23A)PYRIMIDIN6YL)PROPANOICACID
CC1=C(C(=O)N2C(=C(C(=O)N2)C3=CC=CC=C3)N1)CCC(=O)O
InChI=1SC16H15N3O4c1911(7812(20)21)16(23)1914(179)13(15(22)1819)105324610h2617H78H21H3(H1822)(H2021)
MFCD17430455
OC(=O)CCc1c(C)(nH)c2n(c1=O)(nH)c(=O)c2c1ccccc1
ZINC000049538564
ZINC102569326
ZINC49538564

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Available files

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