2-pentylsulfanyl-N-(2-pyrrol-1-ylethyl)pyridine-3-carboxamide

Systemtic Name: 2-pentylsulfanyl-N-(2-pyrrol-1-ylethyl)pyridine-3-carboxamide Openeye Name: 2-pentylsulfanyl-N-(2-pyrrol-1-ylethyl)pyridine-3-carboxamide CAS Name: 2-(pentylthio)-N-[2-(1-pyrrolyl)ethyl]-3-pyridinecarboxamide IUPAC Name: 2-pentylsulfanyl-N-(2-pyrrol-1-ylethyl)pyridine-3-carboxamide Traditional Name: 2-(amylthio)-N-(2-pyrrol-1-ylethyl)nicotinamide Formula: C17H23N3OS MolecularWeight: 317.44902

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCSC1=C(C=CC=N1)C(=O)NCCN2C=CC=C2

Isomeric SMILES

CCCCCSC1=C(C=CC=N1)C(=O)NCCN2C=CC=C2

InChI

InChI=1S/C17H23N3OS/c1-2-3-6-14-22-17-15(8-7-9-19-17)16(21)18-10-13-20-11-4-5-12-20/h4-5,7-9,11-12H,2-3,6,10,13-14H2,1H3,(H,18,21)