Vitas-M small molecule compound

1'-methyl-6'-nitro-1-(propan-2-yl)-2'-propyl-1',4'-dihydro-2H,2'H-spiro[pyrimidine-5,3'-quinoline]-2,4,6(1H,3H)-trione

Catalog ID
STK595557
SMILES CCCC1N(C)c2ccc(cc2CC21C(=O)NC(=O)N(C2=O)C(C)C)[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 C19H24N4O5 MW 388.42 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H24N4O5/c1-5-6-15-19(16(24)20-18(26)22(11(2)3)17(19)25)10-12-9-13(23(27)28)7-8-14(12)21(15)4/h7-9,11,15H,5-6,10H2,1-4H3,(H,20,24,26)
InChIKey
XWFRPCBJXVPODT-UHFFFAOYSA-N
Synonyms
879467-35-3
1isopropyl1methyl6nitro2propyl24dihydro1H1Hspiro(pyrimidine53quinoline)246(3H)trione
1methyl6nitro1(propan2yl)2propyl14dihydro2H2Hspiro(pyrimidine53quinoline)246(1H3H)trione
1methyl6nitro1propan2yl2propylspiro(13diazinane5324dihydroquinoline)246trione
879467353
CCCC1C2(CC3=C(N1C)C=CC(=C3)(N+)(=O)(O))C(=O)NC(=O)N(C2=O)C(C)C
CCCC1N(C)c2ccc(cc2CC21C(=O)NC(=O)N(C2=O)C(C)C)(N+)(=O)(O)
InChI=1SC19H24N4O5c1561519(16(24)2018(26)22(11(2)3)17(19)25)1012913(23(27)28)7814(12)21(15)4h791115H5610H214H3(H202426)
MFCD07640042
ZINC000008971058
ZINC000008973847

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Available files

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