Vitas-M small molecule compound
ethyl 2-({[4-(piperidin-1-ylmethyl)phenyl]carbamothioyl}amino)-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
Catalog ID
STK456868
SMILES CCOC(=O)c1c(NC(=S)Nc2ccc(cc2)CN2CCCCC2)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)21-19-8-4-5-9-20(19)31-22(21)26-24(30)25-18-12-10-17(11-13-18)16-27-14-6-3-7-15-27/h10-13H,2-9,14-16H2,1H3,(H2,25,26,30)InChIKey
PLAZXBDKTPGRDE-UHFFFAOYSA-NSynonyms
CCOC(=O)C1=C(SC2=C1CCCC2)NC(=S)NC3=CC=C(C=C3)CN4CCCCC4
ethyl2(((4(piperidin1ylmethyl)phenyl)carbamothioyl)amino)4567tetrahydro1benzothiophene3carboxylate
ethyl2((4(piperidin1ylmethyl)phenyl)carbamothioylamino)4567tetrahydro1benzothiophene3carboxylate
InChI=1SC24H31N3O2S2c122923(28)2119845920(19)3122(21)2624(30)2518121017(111318)1627146371527h1013H291416H21H3(H2252630)
MFCD05107920
ZINC000002853292
ZINC2853292
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