Vitas-M small molecule compound
(5E)-1-(3-fluorophenyl)-2-thioxo-5-({1-[3-(trifluoromethyl)phenyl]-1H-pyrrol-2-yl}methylidene)dihydropyrimidine-4,6(1H,5H)-dione
Catalog ID
STK190154
SMILES Fc1cccc(c1)N1C(=S)NC(=O)/C(=C\c2cccn2c2cccc(c2)C(F)(F)F)/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 C22H13F4N3O2S MW 459.42 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H13F4N3O2S/c23-14-5-2-7-17(11-14)29-20(31)18(19(30)27-21(29)32)12-16-8-3-9-28(16)15-6-1-4-13(10-15)22(24,25)26/h1-12H,(H,27,30,32)/b18-12+InChIKey
KZIBUPZZAYHOAS-LDADJPATSA-NSynonyms
(5E)1(3FLUOROPHENYL)2SULFANYLIDENE5((1(3(TRIFLUOROMETHYL)PHENYL)PYRROL2YL)METHYLIDENE)13DIAZINANE46DIONE
(5E)1(3FLUOROPHENYL)2THIOXO5((1(3(TRIFLUOROMETHYL)PHENYL)1HPYRROL2YL)METHYLIDENE)DIHYDROPYRIMIDINE46(1H5H)DIONE
1(3FLUOROPHENYL)2THIOXO5((1(3(TRIFLUOROMETHYL)PHENYL)1HPYRROL2YL)METHYLENE)DIHYDROPYRIMIDINE46(1H5H)DIONE
C1=CC(=CC(=C1)N2C=CC=C2C=C3C(=O)NC(=S)N(C3=O)C4=CC(=CC=C4)F)C(F)(F)F
Fc1cccc(c1)N1C(=S)NC(=O)C(=Cc2cccn2c2cccc(c2)C(F)(F)F)C1=O
InChI=1SC22H13F4N3O2Sc231452717(1114)2920(31)18(19(30)2721(29)32)121683928(16)1561413(1015)22(2425)26h112H(H273032)b1812+
MFCD03697156
ZINC000000661265
ZINC00661265
ZINC661265
Check stock
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Check stock on Vitas-MAvailable files
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