Vitas-M small molecule compound
8,8-dimethyl-5-(pyridin-3-yl)-2-thioxo-2,3,5,8,9,10-hexahydropyrimido[4,5-b]quinoline-4,6(1H,7H)-dione
Catalog ID
STK981122
SMILES O=C1CC(C)(C)CC2=C1C(c1cccnc1)c1c(N2)[nH]c(=S)[nH]c1=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 C18H18N4O2S MW 354.43 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H18N4O2S/c1-18(2)6-10-13(11(23)7-18)12(9-4-3-5-19-8-9)14-15(20-10)21-17(25)22-16(14)24/h3-5,8,12H,6-7H2,1-2H3,(H3,20,21,22,24,25)InChIKey
AXAGNZXPHLDMLX-UHFFFAOYSA-NSynonyms
88dimethyl5(pyridin3yl)2thioxo2358910hexahydropyrimido(45b)quinoline46(1H7H)dione
88dimethyl5pyridin3yl2sulfanylidene57910tetrahydro1Hpyrimido(45b)quinoline46dione
CC1(CC2=C(C(C3=C(N2)NC(=S)NC3=O)C4=CN=CC=C4)C(=O)C1)C
InChI=1SC18H18N4O2Sc118(2)61013(11(23)718)12(94351989)1415(2010)2117(25)2216(14)24h35812H67H212H3(H32021222425)
MFCD18181274
O=C1CC(C)(C)CC2=C1C(c1cccnc1)c1c(N2)(nH)c(=S)(nH)c1=O
ZINC000005563759
ZINC000005563767
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