1-[2-(4-phenylphthalazin-1-yl)sulfanylethanoyl]piperidine-4-carboxamide

Systemtic Name: 1-[2-(4-phenylphthalazin-1-yl)sulfanylethanoyl]piperidine-4-carboxamide Openeye Name: 1-[2-(4-phenylphthalazin-1-yl)sulfanylacetyl]piperidine-4-carboxamide CAS Name: 1-[1-oxo-2-[(4-phenyl-1-phthalazinyl)thio]ethyl]-4-piperidinecarboxamide IUPAC Name: 1-[2-(4-phenylphthalazin-1-yl)sulfanylacetyl]piperidine-4-carboxamide Traditional Name: 1-[2-[(4-phenylphthalazin-1-yl)thio]acetyl]isonipecotamide Formula: C22H22N4O2S MolecularWeight: 406.50068

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1C(=O)N)C(=O)CSC2=NN=C(C3=CC=CC=C32)C4=CC=CC=C4

Isomeric SMILES

C1CN(CCC1C(=O)N)C(=O)CSC2=NN=C(C3=CC=CC=C32)C4=CC=CC=C4

InChI

InChI=1S/C22H22N4O2S/c23-21(28)16-10-12-26(13-11-16)19(27)14-29-22-18-9-5-4-8-17(18)20(24-25-22)15-6-2-1-3-7-15/h1-9,16H,10-14H2,(H2,23,28)