3-oxidanylidene-3-[4-(phenylmethyl)piperazin-1-yl]propanethial

Systemtic Name: 3-oxidanylidene-3-[4-(phenylmethyl)piperazin-1-yl]propanethial Openeye Name: 3-(4-benzylpiperazin-1-yl)-3-oxo-propanethial CAS Name: 3-oxo-3-[4-(phenylmethyl)-1-piperazinyl]propanethial IUPAC Name: 3-(4-benzylpiperazin-1-yl)-3-oxopropanethial Traditional Name: 3-(4-benzylpiperazino)-3-keto-thiopropionaldehyde Formula: C14H18N2OS MolecularWeight: 262.37052

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CC2=CC=CC=C2)C(=O)CC=S

Isomeric SMILES

C1CN(CCN1CC2=CC=CC=C2)C(=O)CC=S

InChI

InChI=1S/C14H18N2OS/c17-14(6-11-18)16-9-7-15(8-10-16)12-13-4-2-1-3-5-13/h1-5,11H,6-10,12H2