Vitas-M small molecule compound
(5E)-5-[(5-bromofuran-2-yl)methylidene]-1-phenyl-3-propyl-2-thioxodihydropyrimidine-4,6(1H,5H)-dione
Catalog ID
STK197967
SMILES CCCN1C(=S)N(c2ccccc2)C(=O)/C(=C/c2ccc(o2)Br)/C1=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 C18H15BrN2O3S MW 419.30 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H15BrN2O3S/c1-2-10-20-16(22)14(11-13-8-9-15(19)24-13)17(23)21(18(20)25)12-6-4-3-5-7-12/h3-9,11H,2,10H2,1H3/b14-11+InChIKey
GDDFZRLYRZEXEH-SDNWHVSQSA-NSynonyms
(5E)5((5bromofuran2yl)methylidene)1phenyl3propyl2sulfanylidene13diazinane46dione
(5E)5((5BROMOFURAN2YL)METHYLIDENE)1PHENYL3PROPYL2THIOXODIHYDROPYRIMIDINE46(1H5H)DIONE
CCCN1C(=O)C(=CC2=CC=C(O2)Br)C(=O)N(C1=S)C3=CC=CC=C3
CCCN1C(=S)N(c2ccccc2)C(=O)C(=Cc2ccc(o2)Br)C1=O
InChI=1SC18H15BrN2O3Sc12102016(22)14(11138915(19)2413)17(23)21(18(20)25)126435712h3911H210H21H3b1411+
MFCD05040012
ZINC000009934532
ZINC09934532
ZINC9934532
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