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8-[(E)-(1-tert-butyl-2,4,6-trioxotetrahydropyrimidin-5(2H)-ylidene)methyl]-1',3,3'-trimethyl-2,3,4,4a-tetrahydro-1H,2'H,6H-spiro[pyrazino[1,2-a]quinoline-5,5'-pyrimidine]-2',4',6'(1'H,3'H)-trione

Catalog ID
STK597696
SMILES CN1CCN2C(C1)C1(Cc3c2ccc(c3)/C=C/2\C(=O)NC(=O)N(C2=O)C(C)(C)C)C(=O)N(C)C(=O)N(C1=O)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 C27H32N6O6 MW 536.59 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H32N6O6/c1-26(2,3)33-21(35)17(20(34)28-24(33)38)12-15-7-8-18-16(11-15)13-27(19-14-29(4)9-10-32(18)19)22(36)30(5)25(39)31(6)23(27)37/h7-8,11-12,19H,9-10,13-14H2,1-6H3,(H,28,34,38)/b17-12+
InChIKey
VIPVLZRGLSNFAT-SFQUDFHCSA-N
Synonyms

(E)8((1(tertbutyl)246trioxotetrahydropyrimidin5(2H)ylidene)methyl)133trimethyl12344a6hexahydro1Hspiro(pyrazino(12a)quinoline55pyrimidine)246(3H)trionehydrochloride
8((E)(1tertbutyl246trioxo13diazinan5ylidene)methyl)133trimethylspiro(13diazinane55244a6tetrahydro1Hpyrazino(12a)quinoline)246trione
8((E)(1tertbutyl246trioxotetrahydropyrimidin5(2H)ylidene)methyl)133trimethyl2344atetrahydro1H2H6Hspiro(pyrazino(12a)quinoline55pyrimidine)246(1H3H)trione
CC(C)(C)N1C(=O)C(=CC2=CC3=C(C=C2)N4CCN(CC4C5(C3)C(=O)N(C(=O)N(C5=O)C)C)C)C(=O)NC1=O
CN1CCN2C(C1)C1(Cc3c2ccc(c3)C=C2C(=O)NC(=O)N(C2=O)C(C)(C)C)C(=O)N(C)C(=O)N(C1=O)C
CN1CCN2C(C1)C1(Cc3c2ccc(c3)C=C2C(=O)NC(=O)N(C2=O)C(C)(C)C)C(=O)N(C)C(=O)N(C1=O)CCl
InChI=1SC27H32N6O6c126(23)3321(35)17(20(34)2824(33)38)1215781816(1115)1327(191429(4)91032(18)19)22(36)30(5)25(39)31(6)23(27)37h78111219H9101314H216H3(H283438)b1712+
MFCD06784124
ZINC000097968379
ZINC000097968380

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Available files

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