Vitas-M small molecule compound
ethyl 2-[(pyrrolidin-1-ylcarbonothioyl)amino]-5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophene-3-carboxylate
Catalog ID
STK438480
SMILES CCOC(=O)c1c(NC(=S)N2CCCC2)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 C17H24N2O2S2 MW 352.52 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H24N2O2S2/c1-2-21-16(20)14-12-8-4-3-5-9-13(12)23-15(14)18-17(22)19-10-6-7-11-19/h2-11H2,1H3,(H,18,22)InChIKey
CSMVAPQLPAEHPW-UHFFFAOYSA-NSynonyms
CCOC(=O)C1=C(SC2=C1CCCCC2)NC(=S)N3CCCC3
ethyl2((pyrrolidin1ylcarbonothioyl)amino)5678tetrahydro4Hcyclohepta(b)thiophene3carboxylate
ethyl2(pyrrolidine1carbothioylamino)5678tetrahydro4Hcyclohepta(b)thiophene3carboxylate
InChI=1SC17H24N2O2S2c122116(20)14128435913(12)2315(14)1817(22)1910671119h211H21H3(H1822)
MFCD03945399
ZINC000005979959
ZINC05979959
ZINC5979959
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