Vitas-M small molecule compound
methyl 2-({[1-(3,4-dichlorobenzyl)-1H-1,2,4-triazol-3-yl]carbamothioyl}amino)-5-(diethylcarbamoyl)-4-methylthiophene-3-carboxylate
Catalog ID
STK456139
SMILES CCN(C(=O)c1sc(c(c1C)C(=O)OC)NC(=S)Nc1ncn(n1)Cc1ccc(c(c1)Cl)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 C22H24Cl2N6O3S2 MW 555.51 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H24Cl2N6O3S2/c1-5-29(6-2)19(31)17-12(3)16(20(32)33-4)18(35-17)26-22(34)27-21-25-11-30(28-21)10-13-7-8-14(23)15(24)9-13/h7-9,11H,5-6,10H2,1-4H3,(H2,26,27,28,34)InChIKey
BSGPFXFCOKMGDE-UHFFFAOYSA-NSynonyms
CCN(CC)C(=O)C1=C(C(=C(S1)NC(=S)NC2=NN(C=N2)CC3=CC(=C(C=C3)Cl)Cl)C(=O)OC)C
InChI=1SC22H24Cl2N6O3S2c1529(62)19(31)1712(3)16(20(32)334)18(3517)2622(34)2721251130(2821)10137814(23)15(24)913h7911H5610H214H3(H226272834)
METHYL2((((1((34DICHLOROPHENYL)METHYL)(124TRIAZOL3YL))AMINO)THIOXOMETHYL)AMINO)5(NNDIETHYLCARBAMOYL)4METHYLTHIOPHENE3CARBOXYLATE
methyl2(((1(34dichlorobenzyl)1H124triazol3yl)carbamothioyl)amino)5(diethylcarbamoyl)4methylthiophene3carboxylate
METHYL2((1((34DICHLOROPHENYL)METHYL)124TRIAZOL3YL)CARBAMOTHIOYLAMINO)5(DIETHYLCARBAMOYL)4METHYLTHIOPHENE3CARBOXYLATE
MFCD05991011
ZINC000002857319
ZINC2857319
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