Vitas-M small molecule compound
ethyl 4-[(6-benzyl-2,5-dimethyl-3-phenylpyrazolo[1,5-a]pyrimidin-7-yl)sulfanyl]-3-oxobutanoate
Catalog ID
STK594086
SMILES CCOC(=O)CC(=O)CSc1c(Cc2ccccc2)c(C)nc2n1nc(c2c1ccccc1)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 C27H27N3O3S MW 473.60 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H27N3O3S/c1-4-33-24(32)16-22(31)17-34-27-23(15-20-11-7-5-8-12-20)18(2)28-26-25(19(3)29-30(26)27)21-13-9-6-10-14-21/h5-14H,4,15-17H2,1-3H3InChIKey
BSKXSQKBPLJYOH-UHFFFAOYSA-NSynonyms
862485-69-6862485696
CCOC(=O)CC(=O)CSC1=C(C(=NC2=C(C(=NN21)C)C3=CC=CC=C3)C)CC4=CC=CC=C4
ethyl4((6benzyl25dimethyl3phenylpyrazolo(15a)pyrimidin7yl)sulfanyl)3oxobutanoate
ethyl4((6benzyl25dimethyl3phenylpyrazolo(15a)pyrimidin7yl)thio)3oxobutanoate
ETHYL4(6BENZYL25DIMETHYL3PHENYLPYRAZOLO(15A)PYRIMIDIN7YL)SULFANYL3OXOBUTANOATE
InChI=1SC27H27N3O3Sc143324(32)1622(31)17342723(1520117581220)18(2)282625(19(3)2930(26)27)211396101421h514H41517H213H3
MFCD05698773
ZINC000009292425
ZINC09292425
ZINC9292425
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