Vitas-M small molecule compound
(5Z)-1-(prop-2-en-1-yl)-2-thioxo-5-({5-[3-(trifluoromethyl)phenyl]furan-2-yl}methylidene)dihydropyrimidine-4,6(1H,5H)-dione
Catalog ID
STK188028
SMILES C=CCN1C(=S)NC(=O)/C(=C/c2ccc(o2)c2cccc(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 C19H13F3N2O3S MW 406.39 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H13F3N2O3S/c1-2-8-24-17(26)14(16(25)23-18(24)28)10-13-6-7-15(27-13)11-4-3-5-12(9-11)19(20,21)22/h2-7,9-10H,1,8H2,(H,23,25,28)/b14-10-InChIKey
UBAPHXPJYNDKID-UVTDQMKNSA-NSynonyms
(5Z)1(PROP2EN1YL)2THIOXO5((5(3(TRIFLUOROMETHYL)PHENYL)FURAN2YL)METHYLIDENE)DIHYDROPYRIMIDINE46(1H5H)DIONE
(5Z)1PROP2ENYL2SULFANYLIDENE5((5(3(TRIFLUOROMETHYL)PHENYL)FURAN2YL)METHYLIDENE)13DIAZINANE46DIONE
C=CCN1C(=O)C(=CC2=CC=C(O2)C3=CC(=CC=C3)C(F)(F)F)C(=O)NC1=S
C=CCN1C(=S)NC(=O)C(=Cc2ccc(o2)c2cccc(c2)C(F)(F)F)C1=O
InChI=1SC19H13F3N2O3Sc1282417(26)14(16(25)2318(24)28)10136715(2713)1143512(911)19(2021)22h27910H18H2(H232528)b1410
MFCD03134680
ZINC000012343710
ZINC12343710
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