2-methylsulfanyl-N-(3-phenoxypropyl)pyridine-3-carboxamide

Systemtic Name: 2-methylsulfanyl-N-(3-phenoxypropyl)pyridine-3-carboxamide Openeye Name: 2-methylsulfanyl-N-(3-phenoxypropyl)pyridine-3-carboxamide CAS Name: 2-(methylthio)-N-(3-phenoxypropyl)-3-pyridinecarboxamide IUPAC Name: 2-methylsulfanyl-N-(3-phenoxypropyl)pyridine-3-carboxamide Traditional Name: 2-(methylthio)-N-(3-phenoxypropyl)nicotinamide Formula: C16H18N2O2S MolecularWeight: 302.39132

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=C(C=CC=N1)C(=O)NCCCOC2=CC=CC=C2

Isomeric SMILES

CSC1=C(C=CC=N1)C(=O)NCCCOC2=CC=CC=C2

InChI

InChI=1S/C16H18N2O2S/c1-21-16-14(9-5-10-18-16)15(19)17-11-6-12-20-13-7-3-2-4-8-13/h2-5,7-10H,6,11-12H2,1H3,(H,17,19)