4-(2-phenylsulfanylethanoyl)piperazine-1-carbaldehyde

Systemtic Name: 4-(2-phenylsulfanylethanoyl)piperazine-1-carbaldehyde Openeye Name: 4-(2-phenylsulfanylacetyl)piperazine-1-carbaldehyde CAS Name: 4-[1-oxo-2-(phenylthio)ethyl]-1-piperazinecarboxaldehyde IUPAC Name: 4-(2-phenylsulfanylacetyl)piperazine-1-carbaldehyde Traditional Name: 4-[2-(phenylthio)acetyl]piperazine-1-carbaldehyde Formula: C13H16N2O2S MolecularWeight: 264.34334

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C=O)C(=O)CSC2=CC=CC=C2

Isomeric SMILES

C1CN(CCN1C=O)C(=O)CSC2=CC=CC=C2

InChI

InChI=1S/C13H16N2O2S/c16-11-14-6-8-15(9-7-14)13(17)10-18-12-4-2-1-3-5-12/h1-5,11H,6-10H2