4-[2-(phenylmethylsulfanyl)propanoyl]piperazine-1-carbaldehyde

Systemtic Name: 4-[2-(phenylmethylsulfanyl)propanoyl]piperazine-1-carbaldehyde Openeye Name: 4-(2-benzylsulfanylpropanoyl)piperazine-1-carbaldehyde CAS Name: 4-[1-oxo-2-(phenylmethylthio)propyl]-1-piperazinecarboxaldehyde IUPAC Name: 4-(2-benzylsulfanylpropanoyl)piperazine-1-carbaldehyde Traditional Name: 4-[2-(benzylthio)propanoyl]piperazine-1-carbaldehyde Formula: C15H20N2O2S MolecularWeight: 292.3965

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)N1CCN(CC1)C=O)SCC2=CC=CC=C2

Isomeric SMILES

CC(C(=O)N1CCN(CC1)C=O)SCC2=CC=CC=C2

InChI

InChI=1S/C15H20N2O2S/c1-13(20-11-14-5-3-2-4-6-14)15(19)17-9-7-16(12-18)8-10-17/h2-6,12-13H,7-11H2,1H3