N-(3-phenylpropyl)-1-(3-phenylsulfanylpyrazin-2-yl)piperidine-3-carboxamide

Systemtic Name: N-(3-phenylpropyl)-1-(3-phenylsulfanylpyrazin-2-yl)piperidine-3-carboxamide Openeye Name: N-(3-phenylpropyl)-1-(3-phenylsulfanylpyrazin-2-yl)piperidine-3-carboxamide CAS Name: N-(3-phenylpropyl)-1-[3-(phenylthio)-2-pyrazinyl]-3-piperidinecarboxamide IUPAC Name: N-(3-phenylpropyl)-1-(3-phenylsulfanylpyrazin-2-yl)piperidine-3-carboxamide Traditional Name: N-(3-phenylpropyl)-1-[3-(phenylthio)pyrazin-2-yl]nipecotamide Formula: C25H28N4OS MolecularWeight: 432.58102

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(CN(C1)C2=NC=CN=C2SC3=CC=CC=C3)C(=O)NCCCC4=CC=CC=C4

Isomeric SMILES

C1CC(CN(C1)C2=NC=CN=C2SC3=CC=CC=C3)C(=O)NCCCC4=CC=CC=C4

InChI

InChI=1S/C25H28N4OS/c30-24(27-15-7-11-20-9-3-1-4-10-20)21-12-8-18-29(19-21)23-25(28-17-16-26-23)31-22-13-5-2-6-14-22/h1-6,9-10,13-14,16-17,21H,7-8,11-12,15,18-19H2,(H,27,30)