Vitas-M small molecule compound
(5E)-5-{[4-(furan-2-ylcarbonyl)piperazin-1-yl]methylidene}-1-(3-methylphenyl)-2-thioxodihydropyrimidine-4,6(1H,5H)-dione
Catalog ID
STL368103
SMILES Cc1cccc(c1)N1C(=S)NC(=O)/C(=C\N2CCN(CC2)C(=O)c2ccco2)/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 C21H20N4O4S MW 424.48 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H20N4O4S/c1-14-4-2-5-15(12-14)25-19(27)16(18(26)22-21(25)30)13-23-7-9-24(10-8-23)20(28)17-6-3-11-29-17/h2-6,11-13H,7-10H2,1H3,(H,22,26,30)/b16-13+InChIKey
MRFXQGMQWKPFLZ-DTQAZKPQSA-NSynonyms
(5E)5((4(2FURANYL(OXO)METHYL)1PIPERAZINYL)METHYLIDENE)1(3METHYLPHENYL)2SULFANYLIDENE13DIAZINANE46DIONE
(5E)5((4(2FUROYL)PIPERAZINO)METHYLENE)1(MTOLYL)2THIOXOHEXAHYDROPYRIMIDINE46QUINONE
(5E)5((4(FURAN2CARBONYL)PIPERAZIN1YL)METHYLIDENE)1(3METHYLPHENYL)2SULFANYLIDENE13DIAZINANE46DIONE
(5E)5((4(FURAN2YLCARBONYL)PIPERAZIN1YL)METHYLIDENE)1(3METHYLPHENYL)2SULFANYLIDENE13DIAZINANE46DIONE
(5E)5((4(furan2ylcarbonyl)piperazin1yl)methylidene)1(3methylphenyl)2thioxodihydropyrimidine46(1H5H)dione
5((4(2FUROYL)1PIPERAZINYL)METHYLENE)1(3METHYLPHENYL)2THIOXODIHYDRO46(1H5H)PYRIMIDINEDIONE
CC1=CC(=CC=C1)N2C(=O)C(=CN3CCN(CC3)C(=O)C4=CC=CO4)C(=O)NC2=S
Cc1cccc(c1)N1C(=S)NC(=O)C(=CN2CCN(CC2)C(=O)c2ccco2)C1=O
InChI=1SC21H20N4O4Sc11442515(1214)2519(27)16(18(26)2221(25)30)13237924(10823)20(28)1763112917h261113H710H21H3(H222630)b1613+
MFCD03785355
ZINC000000627720
ZINC627720
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