Vitas-M small molecule compound
1'-ethyl-3,3'-dimethyl-8-nitro-2'-thioxo-2,3,4,4a-tetrahydro-1H,2'H,6H-spiro[pyrido[1,2-a]quinoline-5,5'-pyrimidine]-4',6'(1'H,3'H)-dione
Catalog ID
STK684339
SMILES CCN1C(=S)N(C)C(=O)C2(C1=O)Cc1cc(ccc1N1C2CC(C)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 C20H24N4O4S MW 416.50 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H24N4O4S/c1-4-22-18(26)20(17(25)21(3)19(22)29)11-13-10-14(24(27)28)5-6-15(13)23-8-7-12(2)9-16(20)23/h5-6,10,12,16H,4,7-9,11H2,1-3H3InChIKey
BOBBKTLZLUOETE-UHFFFAOYSA-NSynonyms
1ethyl33dimethyl8nitro2sulfanylidenespiro(12344a6hexahydrobenzo(c)quinolizine5513diazinane)46dione
1ethyl33dimethyl8nitro2thioxo2344atetrahydro1H2H6Hspiro(pyrido(12a)quinoline55pyrimidine)46(1H3H)dione
CCN1C(=O)C2(CC3=C(C=CC(=C3)(N+)(=O)(O))N4C2CC(CC4)C)C(=O)N(C1=S)C
CCN1C(=S)N(C)C(=O)C2(C1=O)Cc1cc(ccc1N1C2CC(C)CC1)(N+)(=O)(O)
InChI=1SC20H24N4O4Sc142218(26)20(17(25)21(3)19(22)29)11131014(24(27)28)5615(13)238712(2)916(20)23h56101216H47911H213H3
MFCD05260372
ZINC000004624654
ZINC000248004789
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