Vitas-M small molecule compound
methyl 2-({[(1,3-dimethyl-1H-pyrazol-4-yl)methyl](methyl)carbamothioyl}amino)-5-phenylthiophene-3-carboxylate
Catalog ID
STK438835
SMILES COC(=O)c1cc(sc1NC(=S)N(Cc1cn(nc1C)C)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 C20H22N4O2S2 MW 414.55 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H22N4O2S2/c1-13-15(12-24(3)22-13)11-23(2)20(27)21-18-16(19(25)26-4)10-17(28-18)14-8-6-5-7-9-14/h5-10,12H,11H2,1-4H3,(H,21,27)InChIKey
NQJXPKRKRQZQKZ-UHFFFAOYSA-NSynonyms
CC1=NN(C=C1CN(C)C(=S)NC2=C(C=C(S2)C3=CC=CC=C3)C(=O)OC)C
InChI=1SC20H22N4O2S2c11315(1224(3)2213)1123(2)20(27)211816(19(25)264)1017(2818)148657914h51012H11H214H3(H2127)
METHYL2(((((13DIMETHYLPYRAZOL4YL)METHYL)METHYLAMINO)THIOXOMETHYL)AMINO)5PHENYLTHIOPHENE3CARBOXYLATE
methyl2((((13dimethyl1Hpyrazol4yl)methyl)(methyl)carbamothioyl)amino)5phenylthiophene3carboxylate
METHYL2(((13DIMETHYLPYRAZOL4YL)METHYLMETHYLCARBAMOTHIOYL)AMINO)5PHENYLTHIOPHENE3CARBOXYLATE
MFCD03945714
ZINC000017090068
ZINC17090068
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