Vitas-M small molecule compound
tert-butyl (8R,8aS,11aR)-10-(4-methoxyphenyl)-9,11-dioxo-8a,9,10,11,11a,11b-hexahydro-8H-pyrrolo[3',4':3,4]pyrrolo[2,1-a]phthalazine-8-carboxylate
Catalog ID
STK553456
SMILES COc1ccc(cc1)N1C(=O)[C@@H]2[C@H](C1=O)[C@@H](N1C2c2ccccc2C=N1)C(=O)OC(C)(C)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 C25H25N3O5 MW 447.49 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H25N3O5/c1-25(2,3)33-24(31)21-19-18(20-17-8-6-5-7-14(17)13-26-28(20)21)22(29)27(23(19)30)15-9-11-16(32-4)12-10-15/h5-13,18-21H,1-4H3/t18-,19+,20?,21-/m1/s1InChIKey
ISZOPQBEIHDNBZ-JGUMPVPUSA-NSynonyms
1014082-75-7(8R8aS11aR)tertbutyl10(4methoxyphenyl)911dioxo8a9101111a11bhexahydro8Hpyrrolo(3434)pyrrolo(21a)phthalazine8carboxylate
1014082757
CC(C)(C)OC(=O)C1C2C(C3N1N=CC4=CC=CC=C34)C(=O)N(C2=O)C5=CC=C(C=C5)OC
COc1ccc(cc1)N1C(=O)(C@@H)2(C@H)(C1=O)(C@@H)(N1C2c2ccccc2C=N1)C(=O)OC(C)(C)C
InChI=1SC25H25N3O5c125(23)3324(31)211918(2017865714(17)132628(20)21)22(29)27(23(19)30)1591116(324)121015h5131821H14H3t1819+20?21m1s1
MFCD18242716
tertbutyl(8R8aS11aR)10(4methoxyphenyl)911dioxo8a9101111a11bhexahydro8Hpyrrolo(3434)pyrrolo(21a)phthalazine8carboxylate
ZINC000009076245
ZINC000009076246
Check stock
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Check stock on Vitas-MAvailable files
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