Vitas-M small molecule compound
4-[(4,6-dioxo-2-thioxotetrahydropyrimidin-5(2H)-ylidene)methyl]phenyl propanoate
Catalog ID
STK521760
SMILES CCC(=O)Oc1ccc(cc1)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 C14H12N2O4S MW 304.33 g/mol Purity >90% as per NMR
InChI
InChI=1S/C14H12N2O4S/c1-2-11(17)20-9-5-3-8(4-6-9)7-10-12(18)15-14(21)16-13(10)19/h3-7H,2H2,1H3,(H2,15,16,18,19,21)InChIKey
WEYACZAGLDWWKX-UHFFFAOYSA-NSynonyms
(4((46DIOXO2SULFANYLIDENE13DIAZINAN5YLIDENE)METHYL)PHENYL)PROPANOATE
4((46dioxo2thioxotetrahydropyrimidin5(2H)ylidene)methyl)phenylpropanoate
CCC(=O)OC1=CC=C(C=C1)C=C2C(=O)NC(=S)NC2=O
InChI=1SC14H12N2O4Sc1211(17)209538(469)71012(18)1514(21)1613(10)19h37H2H21H3(H21516181921)
MFCD03717129
ZINC000000460719
ZINC00460719
ZINC460719
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