Vitas-M small molecule compound
(5E)-1-(2-ethylphenyl)-5-{[5-(4-fluorophenyl)furan-2-yl]methylidene}-2-sulfanylpyrimidine-4,6(1H,5H)-dione
Catalog ID
STK854292
SMILES CCc1ccccc1N1C(=NC(=O)/C(=C\c2ccc(o2)c2ccc(cc2)F)/C1=O)S
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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 C23H17FN2O3S MW 420.46 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H17FN2O3S/c1-2-14-5-3-4-6-19(14)26-22(28)18(21(27)25-23(26)30)13-17-11-12-20(29-17)15-7-9-16(24)10-8-15/h3-13H,2H2,1H3,(H,25,27,30)/b18-13+InChIKey
HRNVRYHTEGTSSJ-QGOAFFKASA-NSynonyms
(5E)1(2ETHYLPHENYL)5((5(4FLUOROPHENYL)FURAN2YL)METHYLIDENE)2SULFANYLIDENE13DIAZINANE46DIONE
(5E)1(2ethylphenyl)5((5(4fluorophenyl)furan2yl)methylidene)2sulfanylpyrimidine46(1H5H)dione
CCC1=CC=CC=C1N2C(=O)C(=CC3=CC=C(O3)C4=CC=C(C=C4)F)C(=O)NC2=S
CCc1ccccc1N1C(=NC(=O)C(=Cc2ccc(o2)c2ccc(cc2)F)C1=O)S
InChI=1SC23H17FN2O3Sc1214534619(14)2622(28)18(21(27)2523(26)30)1317111220(2917)157916(24)10815h313H2H21H3(H252730)b1813+
MFCD08732022
ZINC000008914538
ZINC8914538
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