Vitas-M small molecule compound
ethyl 5-benzyl-2-({[(1-ethyl-3-methyl-1H-pyrazol-4-yl)methyl](methyl)carbamothioyl}amino)thiophene-3-carboxylate
Catalog ID
STK458410
SMILES CCOC(=O)c1cc(sc1NC(=S)N(Cc1cn(nc1C)CC)C)Cc1ccccc1
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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 C23H28N4O2S2 MW 456.63 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H28N4O2S2/c1-5-27-15-18(16(3)25-27)14-26(4)23(30)24-21-20(22(28)29-6-2)13-19(31-21)12-17-10-8-7-9-11-17/h7-11,13,15H,5-6,12,14H2,1-4H3,(H,24,30)InChIKey
HKMMRYDRBZTEKR-UHFFFAOYSA-NSynonyms
CCN1C=C(C(=N1)C)CN(C)C(=S)NC2=C(C=C(S2)CC3=CC=CC=C3)C(=O)OCC
ETHYL2(((((1ETHYL3METHYLPYRAZOL4YL)METHYL)METHYLAMINO)THIOXOMETHYL)AMINO)5BENZYLTHIOPHENE3CARBOXYLATE
ethyl5benzyl2((((1ethyl3methyl1Hpyrazol4yl)methyl)(methyl)carbamothioyl)amino)thiophene3carboxylate
ETHYL5BENZYL2(((1ETHYL3METHYLPYRAZOL4YL)METHYLMETHYLCARBAMOTHIOYL)AMINO)THIOPHENE3CARBOXYLATE
InChI=1SC23H28N4O2S2c15271518(16(3)2527)1426(4)23(30)242120(22(28)2962)1319(3121)1217108791117h7111315H561214H214H3(H2430)
MFCD05100575
ZINC000002853211
ZINC02853211
ZINC2853211
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