Vitas-M small molecule compound
methyl 2-({[4-bromo-1-(4-chlorobenzyl)-1H-pyrazol-3-yl]carbamothioyl}amino)-5-(diethylcarbamoyl)-4-methylthiophene-3-carboxylate
Catalog ID
STK457577
SMILES CCN(C(=O)c1sc(c(c1C)C(=O)OC)NC(=S)Nc1nn(cc1Br)Cc1ccc(cc1)Cl)CC
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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 C23H25BrClN5O3S2 MW 598.97 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H25BrClN5O3S2/c1-5-29(6-2)21(31)18-13(3)17(22(32)33-4)20(35-18)27-23(34)26-19-16(24)12-30(28-19)11-14-7-9-15(25)10-8-14/h7-10,12H,5-6,11H2,1-4H3,(H2,26,27,28,34)InChIKey
GQQQIBGVEWYABG-UHFFFAOYSA-NSynonyms
CCN(CC)C(=O)C1=C(C(=C(S1)NC(=S)NC2=NN(C=C2Br)CC3=CC=C(C=C3)Cl)C(=O)OC)C
InChI=1SC23H25BrClN5O3S2c1529(62)21(31)1813(3)17(22(32)334)20(3518)2723(34)261916(24)1230(2819)11147915(25)10814h71012H5611H214H3(H226272834)
methyl2(((4bromo1(4chlorobenzyl)1Hpyrazol3yl)carbamothioyl)amino)5(diethylcarbamoyl)4methylthiophene3carboxylate
METHYL2((4BROMO1((4CHLOROPHENYL)METHYL)PYRAZOL3YL)CARBAMOTHIOYLAMINO)5(DIETHYLCARBAMOYL)4METHYLTHIOPHENE3CARBOXYLATE
METHYL5(NNDIETHYLCARBAMOYL)2((((4BROMO1((4CHLOROPHENYL)METHYL)PYRAZOL3YL)AMINO)THIOXOMETHYL)AMINO)4METHYLTHIOPHENE3CARBOXYLATE
MFCD05991576
ZINC000002858356
ZINC2858356
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