Vitas-M small molecule compound
ethyl 2-({[4-(2-phenylethyl)piperazin-1-yl]carbonothioyl}amino)-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
Catalog ID
STK464963
SMILES CCOC(=O)c1c(NC(=S)N2CCN(CC2)CCc2ccccc2)sc2c1CCCC2
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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 C24H31N3O2S2 MW 457.66 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H31N3O2S2/c1-2-29-23(28)21-19-10-6-7-11-20(19)31-22(21)25-24(30)27-16-14-26(15-17-27)13-12-18-8-4-3-5-9-18/h3-5,8-9H,2,6-7,10-17H2,1H3,(H,25,30)InChIKey
VEUVGFMXJKVPEY-UHFFFAOYSA-NSynonyms
CCOC(=O)C1=C(SC2=C1CCCC2)NC(=S)N3CCN(CC3)CCC4=CC=CC=C4
ethyl2(((4(2phenylethyl)piperazin1yl)carbonothioyl)amino)4567tetrahydro1benzothiophene3carboxylate
ethyl2((4(2phenylethyl)piperazine1carbothioyl)amino)4567tetrahydro1benzothiophene3carboxylate
InChI=1SC24H31N3O2S2c122923(28)211910671120(19)3122(21)2524(30)27161426(151727)1312188435918h3589H2671017H21H3(H2530)
MFCD06111709
ZINC000020168460
ZINC20168460
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