Vitas-M small molecule compound
1-(1,1-dioxidotetrahydrothiophen-3-yl)-4-(2-oxo-2-phenylethyl)-1,4-dihydro-5H-pyrazolo[4,3-d]pyrimidin-5-one
Catalog ID
STL278185
SMILES O=C(c1ccccc1)Cn1c(=O)ncc2c1cnn2C1CCS(=O)(=O)C1
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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 C17H16N4O4S MW 372.40 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H16N4O4S/c22-16(12-4-2-1-3-5-12)10-20-14-9-19-21(15(14)8-18-17(20)23)13-6-7-26(24,25)11-13/h1-5,8-9,13H,6-7,10-11H2InChIKey
CCYFQGYQYXTNKQ-UHFFFAOYSA-NSynonyms
1(11dioxidotetrahydrothiophen3yl)4(2oxo2phenylethyl)14dihydro5Hpyrazolo(43d)pyrimidin5one
1(11dioxothiolan3yl)4phenacylpyrazolo(43d)pyrimidin5one
C1CS(=O)(=O)CC1N2C3=C(C=N2)N(C(=O)N=C3)CC(=O)C4=CC=CC=C4
InChI=1SC17H16N4O4Sc2216(124213512)10201491921(15(14)81817(20)23)136726(2425)1113h158913H671011H2
MFCD24855515
ZINC000032616632
ZINC000032616634
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