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

Systemtic Name: 2-[(3-bromophenyl)methylsulfanyl]-N-(thiophen-2-ylmethyl)pyridine-3-carboxamide Openeye Name: 2-[(3-bromophenyl)methylsulfanyl]-N-(2-thienylmethyl)pyridine-3-carboxamide CAS Name: 2-[(3-bromophenyl)methylthio]-N-(thiophen-2-ylmethyl)-3-pyridinecarboxamide IUPAC Name: 2-[(3-bromophenyl)methylsulfanyl]-N-(thiophen-2-ylmethyl)pyridine-3-carboxamide Traditional Name: 2-[(3-bromobenzyl)thio]-N-(2-thenyl)nicotinamide Formula: C18H15BrN2OS2 MolecularWeight: 419.3585

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)Br)CSC2=C(C=CC=N2)C(=O)NCC3=CC=CS3

Isomeric SMILES

C1=CC(=CC(=C1)Br)CSC2=C(C=CC=N2)C(=O)NCC3=CC=CS3

InChI

InChI=1S/C18H15BrN2OS2/c19-14-5-1-4-13(10-14)12-24-18-16(7-2-8-20-18)17(22)21-11-15-6-3-9-23-15/h1-10H,11-12H2,(H,21,22)