Vitas-M small molecule compound
ethyl 2-({[(1,3-dimethyl-1H-pyrazol-4-yl)methyl](methyl)carbamothioyl}amino)-5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophene-3-carboxylate
Catalog ID
STK438566
SMILES CCOC(=O)c1c(NC(=S)N(Cc2cn(nc2C)C)C)sc2c1CCCCC2
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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 C20H28N4O2S2 MW 420.60 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H28N4O2S2/c1-5-26-19(25)17-15-9-7-6-8-10-16(15)28-18(17)21-20(27)23(3)11-14-12-24(4)22-13(14)2/h12H,5-11H2,1-4H3,(H,21,27)InChIKey
LHNFSDFDNZASNX-UHFFFAOYSA-NSynonyms
CCOC(=O)C1=C(SC2=C1CCCCC2)NC(=S)N(C)CC3=CN(N=C3C)C
ethyl2((((13dimethyl1Hpyrazol4yl)methyl)(methyl)carbamothioyl)amino)5678tetrahydro4Hcyclohepta(b)thiophene3carboxylate
ethyl2(((13dimethylpyrazol4yl)methylmethylcarbamothioyl)amino)5678tetrahydro4Hcyclohepta(b)thiophene3carboxylate
InChI=1SC20H28N4O2S2c152619(25)171597681016(15)2818(17)2120(27)23(3)11141224(4)2213(14)2h12H511H214H3(H2127)
MFCD03945443
ZINC000005979957
ZINC05979957
ZINC5979957
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