Vitas-M small molecule compound
5-{[2-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-oxoethyl]sulfanyl}-2,6-diethyl-2,6-dihydro-7H-pyrazolo[4,3-d]pyrimidin-7-one
Catalog ID
STK309623
SMILES CCn1c(SCC(=O)c2ccc3c(c2)OCCO3)nc2c(c1=O)nn(c2)CC
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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 C19H20N4O4S MW 400.46 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H20N4O4S/c1-3-22-10-13-17(21-22)18(25)23(4-2)19(20-13)28-11-14(24)12-5-6-15-16(9-12)27-8-7-26-15/h5-6,9-10H,3-4,7-8,11H2,1-2H3InChIKey
GBQIVFYFMBEQPN-UHFFFAOYSA-NSynonyms
832139-37-45((2(23dihydro14benzodioxin6yl)2oxoethyl)sulfanyl)26diethyl26dihydro7Hpyrazolo(43d)pyrimidin7one
5(2(23DIHYDRO14BENZODIOXIN6YL)2OXOETHYL)SULFANYL26DIETHYLPYRAZOLO(43D)PYRIMIDIN7ONE
832139374
CCN1C=C2C(=N1)C(=O)N(C(=N2)SCC(=O)C3=CC4=C(C=C3)OCCO4)CC
InChI=1SC19H20N4O4Sc1322101317(2122)18(25)23(42)19(2013)281114(24)12561516(912)27872615h56910H347811H212H3
MFCD04053168
ZINC000002802485
ZINC02802485
ZINC2802485
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