4-phenylsulfanyl-N-(pyridin-3-ylmethyl)butanamide

Systemtic Name: 4-phenylsulfanyl-N-(pyridin-3-ylmethyl)butanamide Openeye Name: 4-phenylsulfanyl-N-(3-pyridylmethyl)butanamide CAS Name: 4-(phenylthio)-N-(3-pyridinylmethyl)butanamide IUPAC Name: 4-phenylsulfanyl-N-(pyridin-3-ylmethyl)butanamide Traditional Name: 4-(phenylthio)-N-(3-pyridylmethyl)butyramide Formula: C16H18N2OS MolecularWeight: 286.39192

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)SCCCC(=O)NCC2=CN=CC=C2

Isomeric SMILES

C1=CC=C(C=C1)SCCCC(=O)NCC2=CN=CC=C2

InChI

InChI=1S/C16H18N2OS/c19-16(18-13-14-6-4-10-17-12-14)9-5-11-20-15-7-2-1-3-8-15/h1-4,6-8,10,12H,5,9,11,13H2,(H,18,19)