Vitas-M small molecule compound
ethyl 2-({[(1-ethyl-3-methyl-1H-pyrazol-4-yl)methyl](methyl)carbamothioyl}amino)-5-phenylthiophene-3-carboxylate
Catalog ID
STK458451
SMILES CCOC(=O)c1cc(sc1NC(=S)N(Cc1cn(nc1C)CC)C)c1ccccc1
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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 C22H26N4O2S2 MW 442.61 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H26N4O2S2/c1-5-26-14-17(15(3)24-26)13-25(4)22(29)23-20-18(21(27)28-6-2)12-19(30-20)16-10-8-7-9-11-16/h7-12,14H,5-6,13H2,1-4H3,(H,23,29)InChIKey
YRMFHNFUVASPSR-UHFFFAOYSA-NSynonyms
CCN1C=C(C(=N1)C)CN(C)C(=S)NC2=C(C=C(S2)C3=CC=CC=C3)C(=O)OCC
ETHYL2(((((1ETHYL3METHYLPYRAZOL4YL)METHYL)METHYLAMINO)THIOXOMETHYL)AMINO)5PHENYLTHIOPHENE3CARBOXYLATE
ethyl2((((1ethyl3methyl1Hpyrazol4yl)methyl)(methyl)carbamothioyl)amino)5phenylthiophene3carboxylate
ETHYL2(((1ETHYL3METHYLPYRAZOL4YL)METHYLMETHYLCARBAMOTHIOYL)AMINO)5PHENYLTHIOPHENE3CARBOXYLATE
InChI=1SC22H26N4O2S2c15261417(15(3)2426)1325(4)22(29)232018(21(27)2862)1219(3020)16108791116h71214H5613H214H3(H2329)
MFCD05055947
ZINC000001121523
ZINC01121523
ZINC1121523
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