Vitas-M small molecule compound
ethyl 2-[(2,3-dihydro-1H-indol-1-ylcarbonothioyl)amino]-5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophene-3-carboxylate
Catalog ID
STK438478
SMILES CCOC(=O)c1c(sc2c1CCCCC2)NC(=S)N1CCc2c1cccc2
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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 C21H24N2O2S2 MW 400.57 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H24N2O2S2/c1-2-25-20(24)18-15-9-4-3-5-11-17(15)27-19(18)22-21(26)23-13-12-14-8-6-7-10-16(14)23/h6-8,10H,2-5,9,11-13H2,1H3,(H,22,26)InChIKey
KRMJWVIELBYNAZ-UHFFFAOYSA-NSynonyms
CCOC(=O)C1=C(SC2=C1CCCCC2)NC(=S)N3CCC4=CC=CC=C43
ethyl2((23dihydro1Hindol1ylcarbonothioyl)amino)5678tetrahydro4Hcyclohepta(b)thiophene3carboxylate
ethyl2(23dihydroindole1carbothioylamino)5678tetrahydro4Hcyclohepta(b)thiophene3carboxylate
InChI=1SC21H24N2O2S2c122520(24)181594351117(15)2719(18)2221(26)231312148671016(14)23h6810H2591113H21H3(H2226)
MFCD03945397
ZINC000005948018
ZINC05948018
ZINC5948018
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