Vitas-M small molecule compound

1-(4-chlorophenyl)-7'-nitro-1',2',3',3a'-tetrahydro-2H,5'H-spiro[pyrimidine-5,4'-pyrrolo[1,2-a]quinoline]-2,4,6(1H,3H)-trione

Catalog ID
STK724706
SMILES Clc1ccc(cc1)N1C(=O)NC(=O)C2(C1=O)Cc1cc(ccc1N1C2CCC1)[N+](=O)[O-]

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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 C21H17ClN4O5 MW 440.84 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H17ClN4O5/c22-13-3-5-14(6-4-13)25-19(28)21(18(27)23-20(25)29)11-12-10-15(26(30)31)7-8-16(12)24-9-1-2-17(21)24/h3-8,10,17H,1-2,9,11H2,(H,23,27,29)
InChIKey
QHIVKBRVVQMSNR-UHFFFAOYSA-N
Synonyms
727369-16-6
1(4chlorophenyl)7nitro1233atetrahydro2H5Hspiro(pyrimidine54pyrrolo(12a)quinoline)246(1H3H)trione
1(4chlorophenyl)7nitro233a5tetrahydro1H1Hspiro(pyrimidine54pyrrolo(12a)quinoline)246(3H)trione
1(4chlorophenyl)7nitrospiro(13diazinane54233a5tetrahydro1Hpyrrolo(12a)quinoline)246trione
727369166
C1CC2C3(CC4=C(N2C1)C=CC(=C4)(N+)(=O)(O))C(=O)NC(=O)N(C3=O)C5=CC=C(C=C5)Cl
Clc1ccc(cc1)N1C(=O)NC(=O)C2(C1=O)Cc1cc(ccc1N1C2CCC1)(N+)(=O)(O)
InChI=1SC21H17ClN4O5c22133514(6413)2519(28)21(18(27)2320(25)29)11121015(26(30)31)7816(12)2491217(21)24h381017H12911H2(H232729)
MFCD06191571
ZINC000008994184
ZINC000230054232

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Available files

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