Vitas-M small molecule compound
(5E)-5-[(cyclopropylamino)methylidene]-1-(2-phenylethyl)-2-sulfanylpyrimidine-4,6(1H,5H)-dione
Catalog ID
STL051308
SMILES SC1=NC(=O)/C(=C\NC2CC2)/C(=O)N1CCc1ccccc1
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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 C16H17N3O2S MW 315.40 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H17N3O2S/c20-14-13(10-17-12-6-7-12)15(21)19(16(22)18-14)9-8-11-4-2-1-3-5-11/h1-5,10,12,17H,6-9H2,(H,18,20,22)/b13-10+InChIKey
BEYSQDJACFONMB-JLHYYAGUSA-NSynonyms
(5E)5((cyclopropylamino)methylidene)1(2phenylethyl)2sulfanylidene13diazinane46dione
(5E)5((cyclopropylamino)methylidene)1(2phenylethyl)2sulfanylpyrimidine46(1H5H)dione
(5E)5((CYCLOPROPYLAMINO)METHYLIDENE)1PHENETHYL2SULFANYLIDENE13DIAZINANE46DIONE
InChI=1SC16H17N3O2Sc201413(1017126712)15(21)19(16(22)1814)98114213511h15101217H69H2(H182022)b1310+
MFCD05732534
SC1=NC(=O)C(=CNC2CC2)C(=O)N1CCc1ccccc1
ZINC000005626360
ZINC5626360
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