ethyl 4-[2-(furan-2-ylcarbonylamino)-4-methylsulfanyl-butanoyl]piperazine-1-carboxylate

Systemtic Name: ethyl 4-[2-(furan-2-ylcarbonylamino)-4-methylsulfanyl-butanoyl]piperazine-1-carboxylate Openeye Name: ethyl 4-[2-(furan-2-carbonylamino)-4-methylsulfanyl-butanoyl]piperazine-1-carboxylate CAS Name: 4-[2-[[2-furanyl(oxo)methyl]amino]-4-(methylthio)-1-oxobutyl]-1-piperazinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-[2-(furan-2-carbonylamino)-4-methylsulfanylbutanoyl]piperazine-1-carboxylate Traditional Name: 4-[2-(2-furoylamino)-4-(methylthio)butanoyl]piperazine-1-carboxylic acid ethyl ester Formula: C17H25N3O5S MolecularWeight: 383.4625

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)N1CCN(CC1)C(=O)C(CCSC)NC(=O)C2=CC=CO2

Isomeric SMILES

CCOC(=O)N1CCN(CC1)C(=O)C(CCSC)NC(=O)C2=CC=CO2

InChI

InChI=1S/C17H25N3O5S/c1-3-24-17(23)20-9-7-19(8-10-20)16(22)13(6-12-26-2)18-15(21)14-5-4-11-25-14/h4-5,11,13H,3,6-10,12H2,1-2H3,(H,18,21)