Vitas-M small molecule compound
ethyl 2-({[(4-chloro-1-ethyl-1H-pyrazol-5-yl)carbonyl]carbamothioyl}amino)-6-methyl-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
Catalog ID
STK317636
SMILES CCOC(=O)c1c(NC(=S)NC(=O)c2c(Cl)cnn2CC)sc2c1CCC(C2)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 C19H23ClN4O3S2 MW 455.00 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H23ClN4O3S2/c1-4-24-15(12(20)9-21-24)16(25)22-19(28)23-17-14(18(26)27-5-2)11-7-6-10(3)8-13(11)29-17/h9-10H,4-8H2,1-3H3,(H2,22,23,25,28)InChIKey
VIHDMFMNIMRASM-UHFFFAOYSA-NSynonyms
494218-59-6494218596
CCN1C(=C(C=N1)Cl)C(=O)NC(=S)NC2=C(C3=C(S2)CC(CC3)C)C(=O)OCC
ethyl2((((4chloro1ethyl1Hpyrazol5yl)carbonyl)carbamothioyl)amino)6methyl4567tetrahydro1benzothiophene3carboxylate
ethyl2((4chloro2ethylpyrazole3carbonyl)carbamothioylamino)6methyl4567tetrahydro1benzothiophene3carboxylate
InChI=1SC19H23ClN4O3S2c142415(12(20)92124)16(25)2219(28)231714(18(26)2752)117610(3)813(11)2917h910H48H213H3(H222232528)
MFCD02374172
ZINC000000649976
ZINC000000649977
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