Vitas-M small molecule compound

1,1',3-trimethyl-6'-nitro-2'-phenyl-2-thioxo-1',4'-dihydro-2H,2'H-spiro[pyrimidine-5,3'-quinoline]-4,6(1H,3H)-dione

Catalog ID
STK604594
SMILES S=C1N(C)C(=O)C2(C(=O)N1C)Cc1cc(ccc1N(C2c1ccccc1)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 C21H20N4O4S MW 424.48 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H20N4O4S/c1-22-16-10-9-15(25(28)29)11-14(16)12-21(17(22)13-7-5-4-6-8-13)18(26)23(2)20(30)24(3)19(21)27/h4-11,17H,12H2,1-3H3
InChIKey
RDIJGBGJCJDHKZ-UHFFFAOYSA-N
Synonyms
903202-84-6
113trimethyl6nitro2phenyl2sulfanylidenespiro(13diazinane5324dihydroquinoline)46dione
113trimethyl6nitro2phenyl2thioxo14dihydro2H2Hspiro(pyrimidine53quinoline)46(1H3H)dione
113trimethyl6nitro2phenyl2thioxo2234tetrahydro1H1Hspiro(pyrimidine53quinoline)46dione
903202846
CN1C(C2(CC3=C1C=CC(=C3)(N+)(=O)(O))C(=O)N(C(=S)N(C2=O)C)C)C4=CC=CC=C4
InChI=1SC21H20N4O4Sc1221610915(25(28)29)1114(16)1221(17(22)137546813)18(26)23(2)20(30)24(3)19(21)27h41117H12H213H3
MFCD08285513
S=C1N(C)C(=O)C2(C(=O)N1C)Cc1cc(ccc1N(C2c1ccccc1)C)(N+)(=O)(O)
ZINC000008997522
ZINC000008997523

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Available files

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