5-bromanyl-N-[2-(4-methylphenyl)sulfanylethyl]pyridine-3-carboxamide

Systemtic Name: 5-bromanyl-N-[2-(4-methylphenyl)sulfanylethyl]pyridine-3-carboxamide Openeye Name: 5-bromo-N-[2-(p-tolylsulfanyl)ethyl]pyridine-3-carboxamide CAS Name: 5-bromo-N-[2-[(4-methylphenyl)thio]ethyl]-3-pyridinecarboxamide IUPAC Name: 5-bromo-N-[2-(4-methylphenyl)sulfanylethyl]pyridine-3-carboxamide Traditional Name: 5-bromo-N-[2-(p-tolylthio)ethyl]nicotinamide Formula: C15H15BrN2OS MolecularWeight: 351.2614

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)SCCNC(=O)C2=CC(=CN=C2)Br

Isomeric SMILES

CC1=CC=C(C=C1)SCCNC(=O)C2=CC(=CN=C2)Br

InChI

InChI=1S/C15H15BrN2OS/c1-11-2-4-14(5-3-11)20-7-6-18-15(19)12-8-13(16)10-17-9-12/h2-5,8-10H,6-7H2,1H3,(H,18,19)