1-(3-phenylsulfanylpyrazin-2-yl)-N-(pyridin-3-ylmethyl)piperidine-3-carboxamide

Systemtic Name: 1-(3-phenylsulfanylpyrazin-2-yl)-N-(pyridin-3-ylmethyl)piperidine-3-carboxamide Openeye Name: 1-(3-phenylsulfanylpyrazin-2-yl)-N-(3-pyridylmethyl)piperidine-3-carboxamide CAS Name: 1-[3-(phenylthio)-2-pyrazinyl]-N-(3-pyridinylmethyl)-3-piperidinecarboxamide IUPAC Name: 1-(3-phenylsulfanylpyrazin-2-yl)-N-(pyridin-3-ylmethyl)piperidine-3-carboxamide Traditional Name: 1-[3-(phenylthio)pyrazin-2-yl]-N-(3-pyridylmethyl)nipecotamide Formula: C22H23N5OS MolecularWeight: 405.51592

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(CN(C1)C2=NC=CN=C2SC3=CC=CC=C3)C(=O)NCC4=CN=CC=C4

Isomeric SMILES

C1CC(CN(C1)C2=NC=CN=C2SC3=CC=CC=C3)C(=O)NCC4=CN=CC=C4

InChI

InChI=1S/C22H23N5OS/c28-21(26-15-17-6-4-10-23-14-17)18-7-5-13-27(16-18)20-22(25-12-11-24-20)29-19-8-2-1-3-9-19/h1-4,6,8-12,14,18H,5,7,13,15-16H2,(H,26,28)