Vitas-M small molecule compound
(5E)-6-hydroxy-5-({[2-(1H-indol-3-yl)ethyl]amino}methylidene)-2-sulfanylpyrimidin-4(5H)-one
Catalog ID
STL045999
SMILES SC1=NC(=O)/C(=C/NCCc2c[nH]c3c2cccc3)/C(=N1)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 C15H14N4O2S MW 314.37 g/mol Purity >90% as per NMR
InChI
InChI=1S/C15H14N4O2S/c20-13-11(14(21)19-15(22)18-13)8-16-6-5-9-7-17-12-4-2-1-3-10(9)12/h1-4,7-8,16-17H,5-6H2,(H2,18,19,20,21,22)InChIKey
XYPRCRSNSODVKA-UHFFFAOYSA-NSynonyms
(5E)6hydroxy5(((2(1Hindol3yl)ethyl)amino)methylidene)2sulfanylpyrimidin4(5H)one
5(((2INDOL3YLETHYL)AMINO)METHYLENE)2THIOXO13DIHYDROPYRIMIDINE46DIONE
5((2(1HINDOL3YL)ETHYLAMINO)METHYLIDENE)2SULFANYLIDENE13DIAZINANE46DIONE
C1=CC=C2C(=C1)C(=CN2)CCNC=C3C(=O)NC(=S)NC3=O
InChI=1SC15H14N4O2Sc201311(14(21)1915(22)1813)81665971712421310(9)12h14781617H56H2(H21819202122)
MFCD04082047
SC1=NC(=O)C(=CNCCc2c(nH)c3c2cccc3)C(=N1)O
ZINC000005729694
ZINC05729694
ZINC5729694
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