(2S)-2-azanyl-1-[4-(furan-2-ylcarbonyl)piperazin-1-yl]-4-methylsulfanyl-butan-1-one

Systemtic Name: (2S)-2-azanyl-1-[4-(furan-2-ylcarbonyl)piperazin-1-yl]-4-methylsulfanyl-butan-1-one Openeye Name: (2S)-2-amino-1-[4-(furan-2-carbonyl)piperazin-1-yl]-4-methylsulfanyl-butan-1-one CAS Name: (2S)-2-amino-1-[4-[2-furanyl(oxo)methyl]-1-piperazinyl]-4-(methylthio)-1-butanone IUPAC Name: (2S)-2-amino-1-[4-(furan-2-carbonyl)piperazin-1-yl]-4-methylsulfanylbutan-1-one Traditional Name: (2S)-2-amino-1-[4-(2-furoyl)piperazino]-4-(methylthio)butan-1-one Formula: C14H21N3O3S MolecularWeight: 311.39984

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Descriptors Computed from Structure

Canonical SMILES:

CSCCC(C(=O)N1CCN(CC1)C(=O)C2=CC=CO2)N

Isomeric SMILES

CSCC[C@@H](C(=O)N1CCN(CC1)C(=O)C2=CC=CO2)N

InChI

InChI=1S/C14H21N3O3S/c1-21-10-4-11(15)13(18)16-5-7-17(8-6-16)14(19)12-3-2-9-20-12/h2-3,9,11H,4-8,10,15H2,1H3/t11-/m0/s1