N-(3-methylsulfanylphenyl)-1-[2-(naphthalen-1-ylamino)-2-oxidanylidene-ethyl]piperidine-4-carboxamide

Systemtic Name: N-(3-methylsulfanylphenyl)-1-[2-(naphthalen-1-ylamino)-2-oxidanylidene-ethyl]piperidine-4-carboxamide Openeye Name: N-(3-methylsulfanylphenyl)-1-[2-(1-naphthylamino)-2-oxo-ethyl]piperidine-4-carboxamide CAS Name: N-[3-(methylthio)phenyl]-1-[2-(1-naphthalenylamino)-2-oxoethyl]-4-piperidinecarboxamide IUPAC Name: N-(3-methylsulfanylphenyl)-1-[2-(naphthalen-1-ylamino)-2-oxoethyl]piperidine-4-carboxamide Traditional Name: 1-[2-keto-2-(1-naphthylamino)ethyl]-N-[3-(methylthio)phenyl]isonipecotamide Formula: C25H27N3O2S MolecularWeight: 433.56578

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=CC=CC(=C1)NC(=O)C2CCN(CC2)CC(=O)NC3=CC=CC4=CC=CC=C43

Isomeric SMILES

CSC1=CC=CC(=C1)NC(=O)C2CCN(CC2)CC(=O)NC3=CC=CC4=CC=CC=C43

InChI

InChI=1S/C25H27N3O2S/c1-31-21-9-5-8-20(16-21)26-25(30)19-12-14-28(15-13-19)17-24(29)27-23-11-4-7-18-6-2-3-10-22(18)23/h2-11,16,19H,12-15,17H2,1H3,(H,26,30)(H,27,29)