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ethyl (2'R,3'R,5S)-1-benzyl-2'-(4-methoxyphenyl)-2,4,6-trioxo-1,2',3,3',4,6-hexahydro-2H,10b'H-spiro[pyrimidine-5,1'-pyrrolo[2,1-a]phthalazine]-3'-carboxylate

Catalog ID
STK553489
SMILES CCOC(=O)[C@@H]1N2N=Cc3c(C2[C@@]2([C@H]1c1ccc(cc1)OC)C(=O)NC(=O)N(C2=O)Cc1ccccc1)cccc3

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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 C31H28N4O6 MW 552.59 g/mol Purity >90% as per NMR
InChI
InChI=1S/C31H28N4O6/c1-3-41-27(36)25-24(20-13-15-22(40-2)16-14-20)31(26-23-12-8-7-11-21(23)17-32-35(25)26)28(37)33-30(39)34(29(31)38)18-19-9-5-4-6-10-19/h4-17,24-26H,3,18H2,1-2H3,(H,33,37,39)/t24-,25+,26?,31-/m0/s1
InChIKey
ZOEQKGZZYIVJKO-OLBZJMCCSA-N
Synonyms

(1S2R3R)ethyl1benzyl2(4methoxyphenyl)246trioxo2334610bhexahydro1H2Hspiro(pyrimidine51pyrrolo(21a)phthalazine)3carboxylate
CCOC(=O)(C@@H)1N2N=Cc3c(C2(C@@)2((C@H)1c1ccc(cc1)OC)C(=O)NC(=O)N(C2=O)Cc1ccccc1)cccc3
CCOC(=O)C1C(C2(C3N1N=CC4=CC=CC=C34)C(=O)NC(=O)N(C2=O)CC5=CC=CC=C5)C6=CC=C(C=C6)OC
ethyl(2R3R5S)1benzyl2(4methoxyphenyl)246trioxo123346hexahydro2H10bHspiro(pyrimidine51pyrrolo(21a)phthalazine)3carboxylate
ethyl(2R3R5S)1benzyl2(4methoxyphenyl)246trioxospiro(13diazinane51310bdihydro2Hpyrrolo(21a)phthalazine)3carboxylate
InChI=1SC31H28N4O6c134127(36)2524(20131522(402)161420)31(262312871121(23)173235(25)26)28(37)3330(39)34(29(31)38)181995461019h4172426H318H212H3(H333739)t2425+26?31m0s1
MFCD18242718
ZINC000001272349
ZINC000102465532

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Available files

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