Vitas-M small molecule compound
2-ethyl-6-(4-methoxybenzyl)-5-{[2-oxo-2-(pyrrolidin-1-yl)ethyl]sulfanyl}-2,6-dihydro-7H-pyrazolo[4,3-d]pyrimidin-7-one
Catalog ID
STL131334
SMILES COc1ccc(cc1)Cn1c(SCC(=O)N2CCCC2)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 C21H25N5O3S MW 427.53 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H25N5O3S/c1-3-25-13-17-19(23-25)20(28)26(12-15-6-8-16(29-2)9-7-15)21(22-17)30-14-18(27)24-10-4-5-11-24/h6-9,13H,3-5,10-12,14H2,1-2H3InChIKey
OHKUVFPEQXOMJN-UHFFFAOYSA-NSynonyms
2ethyl6((4methoxyphenyl)methyl)5(2oxo2pyrrolidin1ylethyl)sulfanylpyrazolo(43d)pyrimidin7one
2ethyl6(4methoxybenzyl)5((2oxo2(pyrrolidin1yl)ethyl)sulfanyl)26dihydro7Hpyrazolo(43d)pyrimidin7one
CCN1C=C2C(=N1)C(=O)N(C(=N2)SCC(=O)N3CCCC3)CC4=CC=C(C=C4)OC
InChI=1SC21H25N5O3Sc1325131719(2325)20(28)26(12156816(292)9715)21(2217)301418(27)2410451124h6913H35101214H212H3
MFCD14977590
ZINC000009299854
ZINC9299854
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