Vitas-M small molecule compound
ethyl 2-({[4-(2-hydroxyphenyl)piperazin-1-yl]carbonothioyl}amino)-5-methyl-4-phenylthiophene-3-carboxylate
Catalog ID
STK446308
SMILES CCOC(=O)c1c(NC(=S)N2CCN(CC2)c2ccccc2O)sc(c1c1ccccc1)C
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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 C25H27N3O3S2 MW 481.64 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H27N3O3S2/c1-3-31-24(30)22-21(18-9-5-4-6-10-18)17(2)33-23(22)26-25(32)28-15-13-27(14-16-28)19-11-7-8-12-20(19)29/h4-12,29H,3,13-16H2,1-2H3,(H,26,32)InChIKey
QKDQCKBWGFTROB-UHFFFAOYSA-NSynonyms
CCOC(=O)C1=C(SC(=C1C2=CC=CC=C2)C)NC(=S)N3CCN(CC3)C4=CC=CC=C4O
ethyl2(((4(2hydroxyphenyl)piperazin1yl)carbonothioyl)amino)5methyl4phenylthiophene3carboxylate
ETHYL2(((4(2HYDROXYPHENYL)PIPERAZINYL)THIOXOMETHYL)AMINO)5METHYL4PHENYLTHIOPHENE3CARBOXYLATE
ethyl2((4(2hydroxyphenyl)piperazine1carbothioyl)amino)5methyl4phenylthiophene3carboxylate
InChI=1SC25H27N3O3S2c133124(30)2221(1895461018)17(2)3323(22)2625(32)28151327(141628)1911781220(19)29h41229H31316H212H3(H2632)
MFCD04058727
ZINC000020168131
ZINC20168131
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