Vitas-M small molecule compound
ethyl 2-[(benzylcarbamothioyl)amino]-5-methyl-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
Catalog ID
STK058450
SMILES CCOC(=O)c1c(NC(=S)NCc2ccccc2)sc2c1CC(C)CC2
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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 C20H24N2O2S2 MW 388.55 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H24N2O2S2/c1-3-24-19(23)17-15-11-13(2)9-10-16(15)26-18(17)22-20(25)21-12-14-7-5-4-6-8-14/h4-8,13H,3,9-12H2,1-2H3,(H2,21,22,25)InChIKey
XOXORYWDPAORNU-UHFFFAOYSA-NSynonyms
328068-60-6328068606
CCOC(=O)C1=C(SC2=C1CC(CC2)C)NC(=S)NCC3=CC=CC=C3
CCOC(=O)c1c(NC(=S)NCc2ccccc2)sc2c1CC(C)CC2
ethyl2((benzylcarbamothioyl)amino)5methyl4567tetrahydro1benzothiophene3carboxylate
ethyl2(3benzylthioureido)5methyl4567tetrahydrobenzo(b)thiophene3carboxylate
ethyl2(benzylcarbamothioylamino)5methyl4567tetrahydro1benzothiophene3carboxylate
InChI=1SC20H24N2O2S2c132419(23)17151113(2)91016(15)2618(17)2220(25)2112147546814h4813H3912H212H3(H2212225)
MFCD01557924
STK058450
ZINC000000985770
ZINC000000985771
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