Vitas-M small molecule compound
(5Z)-1-(3-fluorophenyl)-5-{[1-(prop-2-en-1-yl)-1H-indol-3-yl]methylidene}-2-thioxodihydropyrimidine-4,6(1H,5H)-dione
Catalog ID
STK187845
SMILES C=CCn1cc(c2c1cccc2)/C=C\1/C(=O)NC(=S)N(C1=O)c1cccc(c1)F
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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 C22H16FN3O2S MW 405.45 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H16FN3O2S/c1-2-10-25-13-14(17-8-3-4-9-19(17)25)11-18-20(27)24-22(29)26(21(18)28)16-7-5-6-15(23)12-16/h2-9,11-13H,1,10H2,(H,24,27,29)/b18-11-InChIKey
CNIYJALLARJXMF-WQRHYEAKSA-NSynonyms
676588-15-1(5Z)1(3FLUOROPHENYL)5((1(PROP2EN1YL)1HINDOL3YL)METHYLIDENE)2THIOXODIHYDROPYRIMIDINE46(1H5H)DIONE
(5Z)1(3FLUOROPHENYL)5((1PROP2ENYLINDOL3YL)METHYLIDENE)2SULFANYLIDENE13DIAZINANE46DIONE
676588151
C=CCN1C=C(C2=CC=CC=C21)C=C3C(=O)NC(=S)N(C3=O)C4=CC(=CC=C4)F
C=CCn1cc(c2c1cccc2)C=C1C(=O)NC(=S)N(C1=O)c1cccc(c1)F
InChI=1SC22H16FN3O2Sc1210251314(17834919(17)25)111820(27)2422(29)26(21(18)28)1675615(23)1216h291113H110H2(H242729)b1811
MFCD04277669
ZINC000004711403
ZINC04711403
ZINC4711403
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