Vitas-M small molecule compound

5-[(4,6-dioxo-2-thioxotetrahydropyrimidin-5(2H)-ylidene)methyl]-2-methoxyphenyl benzoate

Catalog ID
STK021147
SMILES COc1ccc(cc1OC(=O)c1ccccc1)C=C1C(=O)NC(=S)NC1=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 C19H14N2O5S MW 382.40 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H14N2O5S/c1-25-14-8-7-11(9-13-16(22)20-19(27)21-17(13)23)10-15(14)26-18(24)12-5-3-2-4-6-12/h2-10H,1H3,(H2,20,21,22,23,27)
InChIKey
LTDPFFVXCQDGPH-UHFFFAOYSA-N
Synonyms
402581-70-8
(5((46DIOXO2SULFANYLIDENE13DIAZINAN5YLIDENE)METHYL)2METHOXYPHENYL)BENZOATE
402581708
5((46DIOXO2THIOXOTETRAHYDROPYRIMIDIN5(2H)YLIDENE)METHYL)2METHOXYPHENYLBENZOATE
COC1=C(C=C(C=C1)C=C2C(=O)NC(=S)NC2=O)OC(=O)C3=CC=CC=C3
COc1ccc(cc1OC(=O)c1ccccc1)C=C1C(=O)NC(=S)NC1=O
InChI=1SC19H14N2O5Sc125148711(91316(22)2019(27)2117(13)23)1015(14)2618(24)125324612h210H1H3(H22021222327)
MFCD02609286
STK021147
ZINC000000862290
ZINC00862290
ZINC862290

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Available files

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