Vitas-M small molecule compound
methyl 2-({[1-(2,4-dichlorobenzyl)-3,5-dimethyl-1H-pyrazol-4-yl]carbamothioyl}amino)-5-methylthiophene-3-carboxylate
Catalog ID
STK453907
SMILES COC(=O)c1cc(sc1NC(=S)Nc1c(C)nn(c1C)Cc1ccc(cc1Cl)Cl)C
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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 C20H20Cl2N4O2S2 MW 483.44 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H20Cl2N4O2S2/c1-10-7-15(19(27)28-4)18(30-10)24-20(29)23-17-11(2)25-26(12(17)3)9-13-5-6-14(21)8-16(13)22/h5-8H,9H2,1-4H3,(H2,23,24,29)InChIKey
UJROYISZDFHANC-UHFFFAOYSA-NSynonyms
CC1=CC(=C(S1)NC(=S)NC2=C(N(N=C2C)CC3=C(C=C(C=C3)Cl)Cl)C)C(=O)OC
InChI=1SC20H20Cl2N4O2S2c110715(19(27)284)18(3010)2420(29)231711(2)2526(12(17)3)9135614(21)816(13)22h58H9H214H3(H2232429)
METHYL2((((1((24DICHLOROPHENYL)METHYL)35DIMETHYLPYRAZOL4YL)AMINO)THIOXOMETHYL)AMINO)5METHYLTHIOPHENE3CARBOXYLATE
methyl2(((1(24dichlorobenzyl)35dimethyl1Hpyrazol4yl)carbamothioyl)amino)5methylthiophene3carboxylate
methyl2((1((24dichlorophenyl)methyl)35dimethylpyrazol4yl)carbamothioylamino)5methylthiophene3carboxylate
MFCD05139324
ZINC000013935430
ZINC13935430
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