Vitas-M small molecule compound
N-[(E)-(1-butyl-4-hydroxy-2,6-dioxo-1,6-dihydropyrimidin-5(2H)-ylidene)methyl]methionine
Catalog ID
STL048915
SMILES CCCCN1C(=O)N=C(/C(=C\NC(C(=O)O)CCSC)/C1=O)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 C14H21N3O5S MW 343.40 g/mol Purity >90% as per NMR
InChI
InChI=1S/C14H21N3O5S/c1-3-4-6-17-12(19)9(11(18)16-14(17)22)8-15-10(13(20)21)5-7-23-2/h8,10,15H,3-7H2,1-2H3,(H,20,21)(H,16,18,22)/b9-8+InChIKey
UCUAATNSIGAMGO-CMDGGOBGSA-NSynonyms
2(((E)(1BUTYL246TRIOXO13DIAZINAN5YLIDENE)METHYL)AMINO)4METHYLSULFANYLBUTANOICACID
CCCCN1C(=O)C(=CNC(CCSC)C(=O)O)C(=O)NC1=O
CCCCN1C(=O)N=C(C(=CNC(C(=O)O)CCSC)C1=O)O
InChI=1SC14H21N3O5Sc13461712(19)9(11(18)1614(17)22)81510(13(20)21)57232h81015H37H212H3(H2021)(H161822)b98+
MFCD05734739
N((E)(1butyl4hydroxy26dioxo16dihydropyrimidin5(2H)ylidene)methyl)methionine
ZINC000020462008
ZINC000020462011
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