Vitas-M small molecule compound
(5E)-5-[(cyclopropylamino)methylidene]-1-(4-methoxyphenyl)-2-sulfanylpyrimidine-4,6(1H,5H)-dione
Catalog ID
STK562935
SMILES COc1ccc(cc1)N1C(=NC(=O)/C(=C\NC2CC2)/C1=O)S
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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 C15H15N3O3S MW 317.37 g/mol Purity >90% as per NMR
InChI
InChI=1S/C15H15N3O3S/c1-21-11-6-4-10(5-7-11)18-14(20)12(8-16-9-2-3-9)13(19)17-15(18)22/h4-9,16H,2-3H2,1H3,(H,17,19,22)/b12-8+InChIKey
TXDQBYIKJRMOFA-XYOKQWHBSA-NSynonyms
(5E)5((CYCLOPROPYLAMINO)METHYLIDENE)1(4METHOXYPHENYL)2SULFANYLIDENE13DIAZINANE46DIONE
(5E)5((cyclopropylamino)methylidene)1(4methoxyphenyl)2sulfanylpyrimidine46(1H5H)dione
COC1=CC=C(C=C1)N2C(=O)C(=CNC3CC3)C(=O)NC2=S
COc1ccc(cc1)N1C(=NC(=O)C(=CNC2CC2)C1=O)S
InChI=1SC15H15N3O3Sc121116410(5711)1814(20)12(8169239)13(19)1715(18)22h4916H23H21H3(H171922)b128+
MFCD04081981
ZINC000005817931
ZINC05817931
ZINC5817931
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