Vitas-M small molecule compound
ethyl 4-{[2-methyl-5-(3-methyl-4-oxo-3,4,5,6,7,8-hexahydrophthalazin-1-yl)phenyl]sulfonyl}piperazine-1-carboxylate
Catalog ID
STL571978
SMILES CCOC(=O)N1CCN(CC1)S(=O)(=O)c1cc(ccc1C)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 C23H30N4O5S MW 474.58 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H30N4O5S/c1-4-32-23(29)26-11-13-27(14-12-26)33(30,31)20-15-17(10-9-16(20)2)21-18-7-5-6-8-19(18)22(28)25(3)24-21/h9-10,15H,4-8,11-14H2,1-3H3InChIKey
HMZUJNFSIXFANS-UHFFFAOYSA-NSynonyms
50751364
ethyl4((2methyl5(3methyl4oxo345678hexahydrophthalazin1yl)phenyl)sulfonyl)piperazine1carboxylate
ethyl4(2methyl5(3methyl4oxo5678tetrahydrophthalazin1yl)phenyl)sulfonylpiperazine1carboxylate
InChI=1SC23H30N4O5Sc143223(29)26111327(141226)33(3031)201517(10916(20)2)2118756819(18)22(28)25(3)2421h91015H481114H213H3
MFCD14859561
ZINC000044803314
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