Vitas-M small molecule compound
5-(thiophen-2-yl)-2-thioxo-2,3,5,8,9,10-hexahydropyrimido[4,5-b]quinoline-4,6(1H,7H)-dione
Catalog ID
STK981107
SMILES O=C1CCCC2=C1C(c1cccs1)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 C15H13N3O2S2 MW 331.42 g/mol Purity >90% as per NMR
InChI
InChI=1S/C15H13N3O2S2/c19-8-4-1-3-7-10(8)11(9-5-2-6-22-9)12-13(16-7)17-15(21)18-14(12)20/h2,5-6,11H,1,3-4H2,(H3,16,17,18,20,21)InChIKey
LYUAULAOBACAPB-UHFFFAOYSA-NSynonyms
2sulfanylidene5thiophen2yl1578910hexahydropyrimido(45b)quinoline46dione
5(thiophen2yl)2thioxo2358910hexahydropyrimido(45b)quinoline46(1H7H)dione
C1CC2=C(C(C3=C(N2)NC(=S)NC3=O)C4=CC=CS4)C(=O)C1
InChI=1SC15H13N3O2S2c198413710(8)11(9526229)1213(167)1715(21)1814(12)20h25611H134H2(H31617182021)
MFCD18181266
O=C1CCCC2=C1C(c1cccs1)c1c(N2)(nH)c(=S)(nH)c1=O
ZINC000044973858
ZINC000044973863
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