Vitas-M small molecule compound
(5E)-1-butyl-5-[(1-propyl-1H-indol-3-yl)methylidene]-2-sulfanylpyrimidine-4,6(1H,5H)-dione
Catalog ID
STK566830
SMILES CCCCN1C(=NC(=O)/C(=C\c2cn(c3c2cccc3)CCC)/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 C20H23N3O2S MW 369.49 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H23N3O2S/c1-3-5-11-23-19(25)16(18(24)21-20(23)26)12-14-13-22(10-4-2)17-9-7-6-8-15(14)17/h6-9,12-13H,3-5,10-11H2,1-2H3,(H,21,24,26)/b16-12+InChIKey
PQBDGEPTSXZOCN-FOWTUZBSSA-NSynonyms
573698-02-9(5E)1butyl5((1propyl1Hindol3yl)methylidene)2sulfanylpyrimidine46(1H5H)dione
(5E)1BUTYL5((1PROPYLINDOL3YL)METHYLIDENE)2SULFANYLIDENE13DIAZINANE46DIONE
573698029
CCCCN1C(=NC(=O)C(=Cc2cn(c3c2cccc3)CCC)C1=O)S
CCCCN1C(=O)C(=CC2=CN(C3=CC=CC=C32)CCC)C(=O)NC1=S
InChI=1SC20H23N3O2Sc135112319(25)16(18(24)2120(23)26)12141322(1042)17976815(14)17h691213H351011H212H3(H212426)b1612+
MFCD05724754
ZINC000002437989
ZINC2437989
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