Vitas-M small molecule compound
1-(3-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
STK572736
SMILES Clc1cccc(c1)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/c22-13-3-1-4-14(10-13)25-19(28)21(18(27)23-20(25)29)11-12-9-15(26(30)31)6-7-16(12)24-8-2-5-17(21)24/h1,3-4,6-7,9-10,17H,2,5,8,11H2,(H,23,27,29)InChIKey
ZIPJFMVKSGJOAC-UHFFFAOYSA-NSynonyms
895831-14-81(3chlorophenyl)7nitro1233atetrahydro2H5Hspiro(pyrimidine54pyrrolo(12a)quinoline)246(1H3H)trione
1(3chlorophenyl)7nitro233a5tetrahydro1H1Hspiro(pyrimidine54pyrrolo(12a)quinoline)246(3H)trione
1(3chlorophenyl)7nitrospiro(13diazinane54233a5tetrahydro1Hpyrrolo(12a)quinoline)246trione
895831148
C1CC2C3(CC4=C(N2C1)C=CC(=C4)(N+)(=O)(O))C(=O)NC(=O)N(C3=O)C5=CC(=CC=C5)Cl
Clc1cccc(c1)N1C(=O)NC(=O)C2(C1=O)Cc1cc(ccc1N1C2CCC1)(N+)(=O)(O)
InChI=1SC21H17ClN4O5c221331414(1013)2519(28)21(18(27)2320(25)29)1112915(26(30)31)6716(12)2482517(21)24h1346791017H25811H2(H232729)
MFCD07638074
ZINC000009430435
ZINC000230078184
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