2-methylsulfanyl-N-[[4-(piperidin-1-ylmethyl)phenyl]methyl]pyridine-3-carboxamide

Systemtic Name: 2-methylsulfanyl-N-[[4-(piperidin-1-ylmethyl)phenyl]methyl]pyridine-3-carboxamide Openeye Name: 2-methylsulfanyl-N-[[4-(1-piperidylmethyl)phenyl]methyl]pyridine-3-carboxamide CAS Name: 2-(methylthio)-N-[[4-(1-piperidinylmethyl)phenyl]methyl]-3-pyridinecarboxamide IUPAC Name: 2-methylsulfanyl-N-[[4-(piperidin-1-ylmethyl)phenyl]methyl]pyridine-3-carboxamide Traditional Name: 2-(methylthio)-N-[4-(piperidinomethyl)benzyl]nicotinamide Formula: C20H25N3OS MolecularWeight: 355.497

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=C(C=CC=N1)C(=O)NCC2=CC=C(C=C2)CN3CCCCC3

Isomeric SMILES

CSC1=C(C=CC=N1)C(=O)NCC2=CC=C(C=C2)CN3CCCCC3

InChI

InChI=1S/C20H25N3OS/c1-25-20-18(6-5-11-21-20)19(24)22-14-16-7-9-17(10-8-16)15-23-12-3-2-4-13-23/h5-11H,2-4,12-15H2,1H3,(H,22,24)