Vitas-M small molecule compound
1-benzyl-1'-methyl-6'-nitro-1',4'-dihydro-2H,2'H-spiro[pyrimidine-5,3'-quinoline]-2,4,6(1H,3H)-trione
Catalog ID
STK782040
SMILES O=C1NC(=O)C2(C(=O)N1Cc1ccccc1)CN(C)c1c(C2)cc(cc1)[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 C20H18N4O5 MW 394.39 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H18N4O5/c1-22-12-20(10-14-9-15(24(28)29)7-8-16(14)22)17(25)21-19(27)23(18(20)26)11-13-5-3-2-4-6-13/h2-9H,10-12H2,1H3,(H,21,25,27)InChIKey
DHFFGQZTWVXRPV-UHFFFAOYSA-NSynonyms
728025-95-41benzyl1methyl6nitro14dihydro2H2Hspiro(pyrimidine53quinoline)246(1H3H)trione
1benzyl1methyl6nitro24dihydro1H1Hspiro(pyrimidine53quinoline)246(3H)trione
1benzyl1methyl6nitrospiro(13diazinane5324dihydroquinoline)246trione
728025954
CN1CC2(CC3=C1C=CC(=C3)(N+)(=O)(O))C(=O)NC(=O)N(C2=O)CC4=CC=CC=C4
InChI=1SC20H18N4O5c1221220(1014915(24(28)29)7816(14)22)17(25)2119(27)23(18(20)26)11135324613h29H1012H21H3(H212527)
MFCD06016390
O=C1NC(=O)C2(C(=O)N1Cc1ccccc1)CN(C)c1c(C2)cc(cc1)(N+)(=O)(O)
ZINC000008974214
ZINC000008974217
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