Vitas-M small molecule compound
3,5-dichloro-N-{[5-(3-ethyl[1,2,4]triazolo[3,4-b][1,3,4]thiadiazol-6-yl)-2-methylphenyl]carbamothioyl}-4-methoxybenzamide
Catalog ID
STK389952
SMILES CCc1nnc2n1nc(s2)c1ccc(c(c1)NC(=S)NC(=O)c1cc(Cl)c(c(c1)Cl)OC)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 C21H18Cl2N6O2S2 MW 521.45 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H18Cl2N6O2S2/c1-4-16-26-27-21-29(16)28-19(33-21)11-6-5-10(2)15(9-11)24-20(32)25-18(30)12-7-13(22)17(31-3)14(23)8-12/h5-9H,4H2,1-3H3,(H2,24,25,30,32)InChIKey
AAYDUWFUUPEYQS-UHFFFAOYSA-NSynonyms
(35DICHLORO4METHOXYPHENYL)N(((5(3ETHYL(124TRIAZOLO(34B)134THIADIAZOLIN6YL))2METHYLPHENYL)AMINO)THIOXOMETHYL)CARBOXAMIDE
35dichloroN((5(3ethyl(124)triazolo(34b)(134)thiadiazol6yl)2methylphenyl)carbamothioyl)4methoxybenzamide
CCC1=NN=C2N1N=C(S2)C3=CC(=C(C=C3)C)NC(=S)NC(=O)C4=CC(=C(C(=C4)Cl)OC)Cl
InChI=1SC21H18Cl2N6O2S2c141626272129(16)2819(3321)116510(2)15(911)2420(32)2518(30)12713(22)17(313)14(23)812h59H4H213H3(H224253032)
MFCD07144907
ZINC000004125362
ZINC4125362
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