Vitas-M small molecule compound
1'-cyclopropyl-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
STK724671
SMILES S=C1NC(=O)C2(C(=O)N1C1CC1)Cc1cc(ccc1N1C2CCCC1)[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 C19H20N4O4S MW 400.46 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H20N4O4S/c24-16-19(17(25)22(12-4-5-12)18(28)20-16)10-11-9-13(23(26)27)6-7-14(11)21-8-2-1-3-15(19)21/h6-7,9,12,15H,1-5,8,10H2,(H,20,24,28)InChIKey
IIWQSFYIIPFJMB-UHFFFAOYSA-NSynonyms
879474-07-41cyclopropyl8nitro2sulfanylidenespiro(12344a6hexahydrobenzo(c)quinolizine5513diazinane)46dione
1cyclopropyl8nitro2thioxo1223344a6octahydro1Hspiro(pyrido(12a)quinoline55pyrimidine)46dione
1cyclopropyl8nitro2thioxo2344atetrahydro1H2H6Hspiro(pyrido(12a)quinoline55pyrimidine)46(1H3H)dione
879474074
C1CCN2C(C1)C3(CC4=C2C=CC(=C4)(N+)(=O)(O))C(=O)NC(=S)N(C3=O)C5CC5
InChI=1SC19H20N4O4Sc241619(17(25)22(124512)18(28)2016)1011913(23(26)27)6714(11)21821315(19)21h6791215H15810H2(H202428)
MFCD07639948
S=C1NC(=O)C2(C(=O)N1C1CC1)Cc1cc(ccc1N1C2CCCC1)(N+)(=O)(O)
ZINC000008971596
ZINC000008971604
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