1-[4-cyano-2-(furan-2-yl)-1,3-oxazol-5-yl]-N-(2-phenylsulfanylethyl)piperidine-4-carboxamide

Systemtic Name: 1-[4-cyano-2-(furan-2-yl)-1,3-oxazol-5-yl]-N-(2-phenylsulfanylethyl)piperidine-4-carboxamide Openeye Name: 1-[4-cyano-2-(2-furyl)oxazol-5-yl]-N-(2-phenylsulfanylethyl)piperidine-4-carboxamide CAS Name: 1-[4-cyano-2-(2-furanyl)-5-oxazolyl]-N-[2-(phenylthio)ethyl]-4-piperidinecarboxamide IUPAC Name: 1-[4-cyano-2-(furan-2-yl)-1,3-oxazol-5-yl]-N-(2-phenylsulfanylethyl)piperidine-4-carboxamide Traditional Name: 1-[4-cyano-2-(2-furyl)oxazol-5-yl]-N-[2-(phenylthio)ethyl]isonipecotamide Formula: C22H22N4O3S MolecularWeight: 422.50008

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1C(=O)NCCSC2=CC=CC=C2)C3=C(N=C(O3)C4=CC=CO4)C#N

Isomeric SMILES

C1CN(CCC1C(=O)NCCSC2=CC=CC=C2)C3=C(N=C(O3)C4=CC=CO4)C#N

InChI

InChI=1S/C22H22N4O3S/c23-15-18-22(29-21(25-18)19-7-4-13-28-19)26-11-8-16(9-12-26)20(27)24-10-14-30-17-5-2-1-3-6-17/h1-7,13,16H,8-12,14H2,(H,24,27)