Vitas-M small molecule compound

methyl {4-[(E)-(2-{[(4,6-dimethylpyrimidin-2-yl)sulfanyl]acetyl}hydrazinylidene)methyl]phenoxy}acetate

Catalog ID
STL199667
SMILES COC(=O)COc1ccc(cc1)/C=N/NC(=O)CSc1nc(C)cc(n1)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 C18H20N4O4S MW 388.45 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H20N4O4S/c1-12-8-13(2)21-18(20-12)27-11-16(23)22-19-9-14-4-6-15(7-5-14)26-10-17(24)25-3/h4-9H,10-11H2,1-3H3,(H,22,23)/b19-9+
InChIKey
TXGMOGJIQSMAKS-DJKKODMXSA-N
Synonyms

CC1=CC(=NC(=N1)SCC(=O)NN=CC2=CC=C(C=C2)OCC(=O)OC)C
COC(=O)COc1ccc(cc1)C=NNC(=O)CSc1nc(C)cc(n1)C
InChI=1SC18H20N4O4Sc112813(2)2118(2012)271116(23)22199144615(7514)261017(24)253h49H1011H213H3(H2223)b199+
methyl(4((E)(2(((46dimethylpyrimidin2yl)sulfanyl)acetyl)hydrazinylidene)methyl)phenoxy)acetate
METHYL2(4((E)((2(46DIMETHYLPYRIMIDIN2YL)SULFANYLACETYL)HYDRAZINYLIDENE)METHYL)PHENOXY)ACETATE
MFCD01234404
ZINC000001191876
ZINC33319584

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Available files

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