Vitas-M small molecule compound
ethyl 1-{[2-ethyl-5-(3-methyl-4-oxo-3,4,5,6,7,8-hexahydrophthalazin-1-yl)phenyl]sulfonyl}piperidine-3-carboxylate
Catalog ID
STL572051
SMILES CCOC(=O)C1CCCN(C1)S(=O)(=O)c1cc(ccc1CC)c1nn(C)c(=O)c2c1CCCC2
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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 C25H33N3O5S MW 487.62 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H33N3O5S/c1-4-17-12-13-18(23-20-10-6-7-11-21(20)24(29)27(3)26-23)15-22(17)34(31,32)28-14-8-9-19(16-28)25(30)33-5-2/h12-13,15,19H,4-11,14,16H2,1-3H3InChIKey
RSWRPSQHCRACEO-UHFFFAOYSA-NSynonyms
50751309
ethyl1((2ethyl5(3methyl4oxo345678hexahydrophthalazin1yl)phenyl)sulfonyl)piperidine3carboxylate
ethyl1(2ethyl5(3methyl4oxo5678tetrahydrophthalazin1yl)phenyl)sulfonylpiperidine3carboxylate
InChI=1SC25H33N3O5Sc1417121318(232010671121(20)24(29)27(3)2623)1522(17)34(3132)28148919(1628)25(30)3352h12131519H4111416H213H3
MFCD14859574
ZINC000044803353
ZINC000044803356
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