Vitas-M small molecule compound
(5E)-1-(butan-2-yl)-5-{[(furan-2-ylmethyl)amino]methylidene}-2-sulfanylpyrimidine-4,6(1H,5H)-dione
Catalog ID
STL053701
SMILES CCC(N1C(=NC(=O)/C(=C\NCc2ccco2)/C1=O)S)C
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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 C14H17N3O3S MW 307.37 g/mol Purity >90% as per NMR
InChI
InChI=1S/C14H17N3O3S/c1-3-9(2)17-13(19)11(12(18)16-14(17)21)8-15-7-10-5-4-6-20-10/h4-6,8-9,15H,3,7H2,1-2H3,(H,16,18,21)/b11-8+InChIKey
PJISXNONRCJRPB-DHZHZOJOSA-NSynonyms
(5E)1(butan2yl)5(((furan2ylmethyl)amino)methylidene)2sulfanylpyrimidine46(1H5H)dione
(5E)1butan2yl5((furan2ylmethylamino)methylidene)2sulfanylidene13diazinane46dione
CCC(C)N1C(=O)C(=CNCC2=CC=CO2)C(=O)NC1=S
InChI=1SC14H17N3O3Sc139(2)1713(19)11(12(18)1614(17)21)8157105462010h468915H37H212H3(H161821)b118+
MFCD05730882
ZINC000005817701
ZINC000005817742
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