4-(2-azanyl-3-phenyl-propanoyl)-3-(2-methylsulfanylethyl)piperazin-2-one

Systemtic Name: 4-(2-azanyl-3-phenyl-propanoyl)-3-(2-methylsulfanylethyl)piperazin-2-one Openeye Name: 4-(2-amino-3-phenyl-propanoyl)-3-(2-methylsulfanylethyl)piperazin-2-one CAS Name: 4-(2-amino-1-oxo-3-phenylpropyl)-3-[2-(methylthio)ethyl]-2-piperazinone IUPAC Name: 4-(2-amino-3-phenylpropanoyl)-3-(2-methylsulfanylethyl)piperazin-2-one Traditional Name: 3-[2-(methylthio)ethyl]-4-phenylalanyl-piperazin-2-one Formula: C16H23N3O2S MolecularWeight: 321.43772

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Descriptors Computed from Structure

Canonical SMILES:

CSCCC1C(=O)NCCN1C(=O)C(CC2=CC=CC=C2)N

Isomeric SMILES

CSCCC1C(=O)NCCN1C(=O)C(CC2=CC=CC=C2)N

InChI

InChI=1S/C16H23N3O2S/c1-22-10-7-14-15(20)18-8-9-19(14)16(21)13(17)11-12-5-3-2-4-6-12/h2-6,13-14H,7-11,17H2,1H3,(H,18,20)