2-[4-(phenylmethyl)piperazin-1-yl]-2-sulfanylidene-ethanamide

Systemtic Name: 2-[4-(phenylmethyl)piperazin-1-yl]-2-sulfanylidene-ethanamide Openeye Name: 2-(4-benzylpiperazin-1-yl)-2-thioxo-acetamide CAS Name: 2-[4-(phenylmethyl)-1-piperazinyl]-2-sulfanylideneacetamide IUPAC Name: 2-(4-benzylpiperazin-1-yl)-2-sulfanylideneacetamide Traditional Name: 2-(4-benzylpiperazino)-2-thioxo-acetamide Formula: C13H17N3OS MolecularWeight: 263.35858

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H17N3OS/c14-12(17)13(18)16-8-6-15(7-9-16)10-11-4-2-1-3-5-11/h1-5H,6-10H2,(H2,14,17)