Vitas-M small molecule compound
diethyl 5-({[4-(furan-2-ylcarbonyl)piperazin-1-yl]carbonothioyl}amino)-3-methylthiophene-2,4-dicarboxylate
Catalog ID
STK457006
SMILES CCOC(=O)c1c(NC(=S)N2CCN(CC2)C(=O)c2ccco2)sc(c1C)C(=O)OCC
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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 C21H25N3O6S2 MW 479.58 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H25N3O6S2/c1-4-28-19(26)15-13(3)16(20(27)29-5-2)32-17(15)22-21(31)24-10-8-23(9-11-24)18(25)14-7-6-12-30-14/h6-7,12H,4-5,8-11H2,1-3H3,(H,22,31)InChIKey
BWYRNWJNGLOEOO-UHFFFAOYSA-NSynonyms
CCOC(=O)C1=C(SC(=C1C)C(=O)OCC)NC(=S)N2CCN(CC2)C(=O)C3=CC=CO3
diethyl5(((4(furan2ylcarbonyl)piperazin1yl)carbonothioyl)amino)3methylthiophene24dicarboxylate
DIETHYL5((4(FURAN2CARBONYL)PIPERAZINE1CARBOTHIOYL)AMINO)3METHYLTHIOPHENE24DICARBOXYLATE
ETHYL5(ETHOXYCARBONYL)2(((4(2FURYLCARBONYL)PIPERAZINYL)THIOXOMETHYL)AMINO)4METHYLTHIOPHENE3CARBOXYLATE
InChI=1SC21H25N3O6S2c142819(26)1513(3)16(20(27)2952)3217(15)2221(31)2410823(91124)18(25)1476123014h6712H45811H213H3(H2231)
MFCD05136113
ZINC000016347142
ZINC16347142
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