Vitas-M small molecule compound
ethyl 5-acetyl-2-{[(4,6-dioxo-2-thioxotetrahydropyrimidin-5(2H)-ylidene)methyl]amino}-4-methylthiophene-3-carboxylate
Catalog ID
STK878437
SMILES CCOC(=O)c1c(NC=C2C(=O)NC(=S)NC2=O)sc(c1C)C(=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 C15H15N3O5S2 MW 381.43 g/mol Purity >90% as per NMR
InChI
InChI=1S/C15H15N3O5S2/c1-4-23-14(22)9-6(2)10(7(3)19)25-13(9)16-5-8-11(20)17-15(24)18-12(8)21/h5,16H,4H2,1-3H3,(H2,17,18,20,21,24)InChIKey
RRVNENFBRFJZIM-UHFFFAOYSA-NSynonyms
CCOC(=O)C1=C(SC(=C1C)C(=O)C)NC=C2C(=O)NC(=S)NC2=O
ethyl5acetyl2(((46dioxo2thioxotetrahydropyrimidin5(2H)ylidene)methyl)amino)4methylthiophene3carboxylate
ETHYL5ACETYL2((46DIOXO2SULFANYLIDENE13DIAZINAN5YLIDENE)METHYLAMINO)4METHYLTHIOPHENE3CARBOXYLATE
InChI=1SC15H15N3O5S2c142314(22)96(2)10(7(3)19)2513(9)165811(20)1715(24)1812(8)21h516H4H213H3(H21718202124)
MFCD06252684
ZINC000017297255
ZINC17297255
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