N-[1,1-bis(oxidanylidene)thiolan-3-yl]-5-bromanyl-N-propyl-pyridine-3-carboxamide

Systemtic Name: N-[1,1-bis(oxidanylidene)thiolan-3-yl]-5-bromanyl-N-propyl-pyridine-3-carboxamide Openeye Name: 5-bromo-N-(1,1-dioxothiolan-3-yl)-N-propyl-pyridine-3-carboxamide CAS Name: 5-bromo-N-(1,1-dioxo-3-thiolanyl)-N-propyl-3-pyridinecarboxamide IUPAC Name: 5-bromo-N-(1,1-dioxothiolan-3-yl)-N-propylpyridine-3-carboxamide Traditional Name: 5-bromo-N-(1,1-diketothiolan-3-yl)-N-propyl-nicotinamide Formula: C13H17BrN2O3S MolecularWeight: 361.25468

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCN(C1CCS(=O)(=O)C1)C(=O)C2=CC(=CN=C2)Br

Isomeric SMILES

CCCN(C1CCS(=O)(=O)C1)C(=O)C2=CC(=CN=C2)Br

InChI

InChI=1S/C13H17BrN2O3S/c1-2-4-16(12-3-5-20(18,19)9-12)13(17)10-6-11(14)8-15-7-10/h6-8,12H,2-5,9H2,1H3