Vitas-M small molecule compound
(5Z)-1-(2-ethylphenyl)-5-{[5-(4-methylpiperazin-1-yl)furan-2-yl]methylidene}-2-thioxodihydropyrimidine-4,6(1H,5H)-dione
Catalog ID
STK200988
SMILES CCc1ccccc1N1C(=S)NC(=O)/C(=C/c2ccc(o2)N2CCN(CC2)C)/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 C22H24N4O3S MW 424.52 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H24N4O3S/c1-3-15-6-4-5-7-18(15)26-21(28)17(20(27)23-22(26)30)14-16-8-9-19(29-16)25-12-10-24(2)11-13-25/h4-9,14H,3,10-13H2,1-2H3,(H,23,27,30)/b17-14-InChIKey
LIUQYDCGBFNWRX-VKAVYKQESA-NSynonyms
(5Z)1(2ETHYLPHENYL)5((5(4METHYLPIPERAZIN1YL)FURAN2YL)METHYLIDENE)2SULFANYLIDENE13DIAZINANE46DIONE
(5Z)1(2ETHYLPHENYL)5((5(4METHYLPIPERAZIN1YL)FURAN2YL)METHYLIDENE)2THIOXODIHYDROPYRIMIDINE46(1H5H)DIONE
CCC1=CC=CC=C1N2C(=O)C(=CC3=CC=C(O3)N4CCN(CC4)C)C(=O)NC2=S
CCc1ccccc1N1C(=S)NC(=O)C(=Cc2ccc(o2)N2CCN(CC2)C)C1=O
InChI=1SC22H24N4O3Sc1315645718(15)2621(28)17(20(27)2322(26)30)14168919(2916)25121024(2)111325h4914H31013H212H3(H232730)b1714
MFCD03227029
ZINC000019890470
ZINC19890470
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