Vitas-M small molecule compound
(5Z)-5-{[1-(2-ethyl-6-methylphenyl)-2,5-dimethyl-1H-pyrrol-3-yl]methylidene}-6-hydroxy-2-sulfanylpyrimidin-4(5H)-one
Catalog ID
STK855885
SMILES CCc1cccc(c1n1c(C)cc(c1C)/C=C\1/C(=NC(=NC1=O)S)O)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 C20H21N3O2S MW 367.47 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H21N3O2S/c1-5-14-8-6-7-11(2)17(14)23-12(3)9-15(13(23)4)10-16-18(24)21-20(26)22-19(16)25/h6-10H,5H2,1-4H3,(H2,21,22,24,25,26)InChIKey
ORQCKUGAWDZSNE-UHFFFAOYSA-NSynonyms
CCc1cccc(c1n1c(C)cc(c1C)C=C1C(=NC(=NC1=O)S)O)C
MFCD08731224
ZINC000008997666
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