1-phenyl-N-[4-(pyridin-3-ylmethylsulfanyl)phenyl]cyclobutane-1-carboxamide

Systemtic Name: 1-phenyl-N-[4-(pyridin-3-ylmethylsulfanyl)phenyl]cyclobutane-1-carboxamide Openeye Name: 1-phenyl-N-[4-(3-pyridylmethylsulfanyl)phenyl]cyclobutanecarboxamide CAS Name: 1-phenyl-N-[4-(3-pyridinylmethylthio)phenyl]-1-cyclobutanecarboxamide IUPAC Name: 1-phenyl-N-[4-(pyridin-3-ylmethylsulfanyl)phenyl]cyclobutane-1-carboxamide Traditional Name: 1-phenyl-N-[4-(3-pyridylmethylthio)phenyl]cyclobutanecarboxamide Formula: C23H22N2OS MolecularWeight: 374.49858

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(C1)(C2=CC=CC=C2)C(=O)NC3=CC=C(C=C3)SCC4=CN=CC=C4

Isomeric SMILES

C1CC(C1)(C2=CC=CC=C2)C(=O)NC3=CC=C(C=C3)SCC4=CN=CC=C4

InChI

InChI=1S/C23H22N2OS/c26-22(23(13-5-14-23)19-7-2-1-3-8-19)25-20-9-11-21(12-10-20)27-17-18-6-4-15-24-16-18/h1-4,6-12,15-16H,5,13-14,17H2,(H,25,26)