Vitas-M small molecule compound
(5E)-1-(2-fluorophenyl)-5-{[4-(2-methylpropoxy)naphthalen-1-yl]methylidene}-2-thioxodihydropyrimidine-4,6(1H,5H)-dione
Catalog ID
STL368169
SMILES CC(COc1ccc(c2c1cccc2)/C=C/1\C(=O)NC(=S)N(C1=O)c1ccccc1F)C
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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 C25H21FN2O3S MW 448.52 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H21FN2O3S/c1-15(2)14-31-22-12-11-16(17-7-3-4-8-18(17)22)13-19-23(29)27-25(32)28(24(19)30)21-10-6-5-9-20(21)26/h3-13,15H,14H2,1-2H3,(H,27,29,32)/b19-13+InChIKey
HZOBDRWPYAWISP-CPNJWEJPSA-NSynonyms
(5E)1(2FLUOROPHENYL)5((4(2METHYLPROPOXY)NAPHTHALEN1YL)METHYLIDENE)2SULFANYLIDENE13DIAZINANE46DIONE
(5E)1(2fluorophenyl)5((4(2methylpropoxy)naphthalen1yl)methylidene)2thioxodihydropyrimidine46(1H5H)dione
1(2FLUOROPHENYL)5((4ISOBUTOXY1NAPHTHYL)METHYLENE)2THIOXODIHYDRO46(1H5H)PYRIMIDINEDIONE
CC(C)COC1=CC=C(C2=CC=CC=C21)C=C3C(=O)NC(=S)N(C3=O)C4=CC=CC=C4F
CC(COc1ccc(c2c1cccc2)C=C1C(=O)NC(=S)N(C1=O)c1ccccc1F)C
InChI=1SC25H21FN2O3Sc115(2)143122121116(17734818(17)22)131923(29)2725(32)28(24(19)30)211065920(21)26h31315H14H212H3(H272932)b1913+
MFCD03272023
ZINC000000637618
ZINC00637618
ZINC637618
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