Vitas-M small molecule compound
ethyl 2-({[(1,5-dimethyl-1H-pyrazol-3-yl)methyl]carbamothioyl}amino)-5-methyl-4-phenylthiophene-3-carboxylate
Catalog ID
STK455979
SMILES CCOC(=O)c1c(NC(=S)NCc2nn(c(c2)C)C)sc(c1c1ccccc1)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 C21H24N4O2S2 MW 428.58 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H24N4O2S2/c1-5-27-20(26)18-17(15-9-7-6-8-10-15)14(3)29-19(18)23-21(28)22-12-16-11-13(2)25(4)24-16/h6-11H,5,12H2,1-4H3,(H2,22,23,28)InChIKey
SSVVFEVNLKCRFA-UHFFFAOYSA-NSynonyms
CCOC(=O)C1=C(SC(=C1C2=CC=CC=C2)C)NC(=S)NCC3=NN(C(=C3)C)C
ETHYL2(((((15DIMETHYLPYRAZOL3YL)METHYL)AMINO)THIOXOMETHYL)AMINO)5METHYL4PHENYLTHIOPHENE3CARBOXYLATE
ethyl2((((15dimethyl1Hpyrazol3yl)methyl)carbamothioyl)amino)5methyl4phenylthiophene3carboxylate
ETHYL2((15DIMETHYLPYRAZOL3YL)METHYLCARBAMOTHIOYLAMINO)5METHYL4PHENYLTHIOPHENE3CARBOXYLATE
InChI=1SC21H24N4O2S2c152720(26)1817(1597681015)14(3)2919(18)2321(28)2212161113(2)25(4)2416h611H512H214H3(H2222328)
MFCD04227457
ZINC000002852301
ZINC02852301
ZINC2852301
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