2-[(3-bromophenyl)methylsulfanyl]-N-(3-ethoxypropyl)pyridine-3-carboxamide

Systemtic Name: 2-[(3-bromophenyl)methylsulfanyl]-N-(3-ethoxypropyl)pyridine-3-carboxamide Openeye Name: 2-[(3-bromophenyl)methylsulfanyl]-N-(3-ethoxypropyl)pyridine-3-carboxamide CAS Name: 2-[(3-bromophenyl)methylthio]-N-(3-ethoxypropyl)-3-pyridinecarboxamide IUPAC Name: 2-[(3-bromophenyl)methylsulfanyl]-N-(3-ethoxypropyl)pyridine-3-carboxamide Traditional Name: 2-[(3-bromobenzyl)thio]-N-(3-ethoxypropyl)nicotinamide Formula: C18H21BrN2O2S MolecularWeight: 409.34054

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Descriptors Computed from Structure

Canonical SMILES:

CCOCCCNC(=O)C1=C(N=CC=C1)SCC2=CC(=CC=C2)Br

Isomeric SMILES

CCOCCCNC(=O)C1=C(N=CC=C1)SCC2=CC(=CC=C2)Br

InChI

InChI=1S/C18H21BrN2O2S/c1-2-23-11-5-10-20-17(22)16-8-4-9-21-18(16)24-13-14-6-3-7-15(19)12-14/h3-4,6-9,12H,2,5,10-11,13H2,1H3,(H,20,22)