Vitas-M small molecule compound
methyl 4-{5-[(4,6-dioxo-2-thioxotetrahydropyrimidin-5(2H)-ylidene)methyl]furan-2-yl}benzoate
Catalog ID
STK188383
SMILES COC(=O)c1ccc(cc1)c1ccc(o1)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 C17H12N2O5S MW 356.36 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H12N2O5S/c1-23-16(22)10-4-2-9(3-5-10)13-7-6-11(24-13)8-12-14(20)18-17(25)19-15(12)21/h2-8H,1H3,(H2,18,19,20,21,25)InChIKey
YTEFTAHWJNEOFP-UHFFFAOYSA-NSynonyms
COC(=O)C1=CC=C(C=C1)C2=CC=C(O2)C=C3C(=O)NC(=S)NC3=O
InChI=1SC17H12N2O5Sc12316(22)10429(3510)137611(2413)81214(20)1817(25)1915(12)21h28H1H3(H21819202125)
METHYL4(5((46DIOXO2SULFANYLIDENE13DIAZINAN5YLIDENE)METHYL)FURAN2YL)BENZOATE
METHYL4(5((46DIOXO2THIOXOTETRAHYDROPYRIMIDIN5(2H)YLIDENE)METHYL)FURAN2YL)BENZOATE
MFCD02124364
ZINC000001203954
ZINC01203954
ZINC1203954
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