1-[2-[2-[(2-cyanophenyl)methylsulfanyl]ethylamino]-2-oxidanylidene-ethyl]-N-phenyl-piperidine-3-carboxamide

Systemtic Name: 1-[2-[2-[(2-cyanophenyl)methylsulfanyl]ethylamino]-2-oxidanylidene-ethyl]-N-phenyl-piperidine-3-carboxamide Openeye Name: 1-[2-[2-[(2-cyanophenyl)methylsulfanyl]ethylamino]-2-oxo-ethyl]-N-phenyl-piperidine-3-carboxamide CAS Name: 1-[2-[2-[(2-cyanophenyl)methylthio]ethylamino]-2-oxoethyl]-N-phenyl-3-piperidinecarboxamide IUPAC Name: 1-[2-[2-[(2-cyanophenyl)methylsulfanyl]ethylamino]-2-oxoethyl]-N-phenylpiperidine-3-carboxamide Traditional Name: 1-[2-[2-[(2-cyanobenzyl)thio]ethylamino]-2-keto-ethyl]-N-phenyl-nipecotamide Formula: C24H28N4O2S MolecularWeight: 436.56972

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(CN(C1)CC(=O)NCCSCC2=CC=CC=C2C#N)C(=O)NC3=CC=CC=C3

Isomeric SMILES

C1CC(CN(C1)CC(=O)NCCSCC2=CC=CC=C2C#N)C(=O)NC3=CC=CC=C3

InChI

InChI=1S/C24H28N4O2S/c25-15-19-7-4-5-8-21(19)18-31-14-12-26-23(29)17-28-13-6-9-20(16-28)24(30)27-22-10-2-1-3-11-22/h1-5,7-8,10-11,20H,6,9,12-14,16-18H2,(H,26,29)(H,27,30)