Vitas-M small molecule compound
N-benzyl-2-{[6-(4-chlorobenzyl)-2-ethyl-7-oxo-6,7-dihydro-2H-pyrazolo[4,3-d]pyrimidin-5-yl]sulfanyl}-N-ethylacetamide
Catalog ID
STL131328
SMILES CCN(C(=O)CSc1nc2cn(nc2c(=O)n1Cc1ccc(cc1)Cl)CC)Cc1ccccc1
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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 C25H26ClN5O2S MW 496.03 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H26ClN5O2S/c1-3-29(14-18-8-6-5-7-9-18)22(32)17-34-25-27-21-16-30(4-2)28-23(21)24(33)31(25)15-19-10-12-20(26)13-11-19/h5-13,16H,3-4,14-15,17H2,1-2H3InChIKey
MMTCLOONWJSFOT-UHFFFAOYSA-NSynonyms
CCN1C=C2C(=N1)C(=O)N(C(=N2)SCC(=O)N(CC)CC3=CC=CC=C3)CC4=CC=C(C=C4)Cl
InChI=1SC25H26ClN5O2Sc1329(14188657918)22(32)17342527211630(42)2823(21)24(33)31(25)1519101220(26)131119h51316H34141517H212H3
MFCD14977567
Nbenzyl2((6(4chlorobenzyl)2ethyl7oxo67dihydro2Hpyrazolo(43d)pyrimidin5yl)sulfanyl)Nethylacetamide
Nbenzyl2(6((4chlorophenyl)methyl)2ethyl7oxopyrazolo(43d)pyrimidin5yl)sulfanylNethylacetamide
ZINC000009299834
ZINC9299834
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