Vitas-M small molecule compound
ethyl 2-{[(2,2,2-trichloro-1-{[(4-methoxyphenyl)carbonyl]amino}ethyl)carbamothioyl]amino}-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
Catalog ID
STK809658
SMILES CCOC(=O)c1c(NC(=S)NC(C(Cl)(Cl)Cl)NC(=O)c2ccc(cc2)OC)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 C22H24Cl3N3O4S2 MW 564.94 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H24Cl3N3O4S2/c1-3-32-19(30)16-14-6-4-5-7-15(14)34-18(16)27-21(33)28-20(22(23,24)25)26-17(29)12-8-10-13(31-2)11-9-12/h8-11,20H,3-7H2,1-2H3,(H,26,29)(H2,27,28,33)InChIKey
ZRMITAZLROCINU-UHFFFAOYSA-NSynonyms
CCOC(=O)C1=C(SC2=C1CCCC2)NC(=S)NC(C(Cl)(Cl)Cl)NC(=O)C3=CC=C(C=C3)OC
ethyl2(((222trichloro1(((4methoxyphenyl)carbonyl)amino)ethyl)carbamothioyl)amino)4567tetrahydro1benzothiophene3carboxylate
ethyl2((222trichloro1((4methoxybenzoyl)amino)ethyl)carbamothioylamino)4567tetrahydro1benzothiophene3carboxylate
InChI=1SC22H24Cl3N3O4S2c133219(30)1614645715(14)3418(16)2721(33)2820(22(2324)25)2617(29)1281013(312)11912h81120H37H212H3(H2629)(H2272833)
MFCD00548602
ZINC000002071643
ZINC000002071644
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